(2-acetyloxy-3,8-dimethyl-8a-oxidanyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1H-naphthalen-1-yl) 6-chloranyl-5-methyl-9b-oxidanyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylate

Systemtic Name: (2-acetyloxy-3,8-dimethyl-8a-oxidanyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1H-naphthalen-1-yl) 6-chloranyl-5-methyl-9b-oxidanyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylate Openeye Name: (2-acetoxy-8a-hydroxy-5-isopropenyl-3,8-dimethyl-2,4a,5,6,7,8-hexahydro-1H-naphthalen-1-yl) 6-chloro-9b-hydroxy-5-methyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylate CAS Name: 6-chloro-9b-hydroxy-5-methyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylic acid [2-acetyloxy-8a-hydroxy-3,8-dimethyl-5-(1-methylethenyl)-2,4a,5,6,7,8-hexahydro-1H-naphthalen-1-yl] ester IUPAC Name: (2-acetyloxy-8a-hydroxy-3,8-dimethyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1H-naphthalen-1-yl) 6-chloro-9b-hydroxy-5-methyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylate Traditional Name: 6-chloro-9b-hydroxy-5-methyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylic acid (2-acetoxy-8a-hydroxy-5-isopropenyl-3,8-dimethyl-2,4a,5,6,7,8-hexahydro-1H-naphthalen-1-yl) ester Formula: C29H37ClN2O7 MolecularWeight: 561.06628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2C1(C(C(C(=C2)C)OC(=O)C)OC(=O)C3CC4(C(N3)ON(C5=C4C=CC=C5Cl)C)O)O)C(=C)C

Isomeric SMILES

CC1CCC(C2C1(C(C(C(=C2)C)OC(=O)C)OC(=O)C3CC4(C(N3)ON(C5=C4C=CC=C5Cl)C)O)O)C(=C)C

InChI

InChI=1S/C29H37ClN2O7/c1-14(2)18-11-10-16(4)29(36)20(18)12-15(3)24(37-17(5)33)25(29)38-26(34)22-13-28(35)19-8-7-9-21(30)23(19)32(6)39-27(28)31-22/h7-9,12,16,18,20,22,24-25,27,31,35-36H,1,10-11,13H2,2-6H3