methyl (1R,4aS,9aR)-5-acetyloxy-6-methoxy-7,8-dimethyl-1-phenylselanyl-1,2,4a,9a-tetrahydrocarbazole-9-carboxylate

Systemtic Name: methyl (1R,4aS,9aR)-5-acetyloxy-6-methoxy-7,8-dimethyl-1-phenylselanyl-1,2,4a,9a-tetrahydrocarbazole-9-carboxylate Openeye Name: methyl (1R,4aS,9aR)-5-acetoxy-6-methoxy-7,8-dimethyl-1-phenylselanyl-1,2,4a,9a-tetrahydrocarbazole-9-carboxylate CAS Name: (1R,4aS,9aR)-5-acetyloxy-6-methoxy-7,8-dimethyl-1-(phenylseleno)-1,2,4a,9a-tetrahydrocarbazole-9-carboxylic acid methyl ester IUPAC Name: methyl (1R,4aS,9aR)-5-acetyloxy-6-methoxy-7,8-dimethyl-1-phenylselanyl-1,2,4a,9a-tetrahydrocarbazole-9-carboxylate Traditional Name: (1R,4aS,9aR)-5-acetoxy-6-methoxy-7,8-dimethyl-1-(phenylseleno)-1,2,4a,9a-tetrahydrocarbazole-9-carboxylic acid methyl ester Formula: C25H27NO5Se MolecularWeight: 500.44558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C3C2C=CCC3[Se]C4=CC=CC=C4)C(=O)OC)OC(=O)C)OC)C

Isomeric SMILES

CC1=C(C(=C(C2=C1N([C@@H]3[C@H]2C=CC[C@H]3[Se]C4=CC=CC=C4)C(=O)OC)OC(=O)C)OC)C

InChI

InChI=1S/C25H27NO5Se/c1-14-15(2)23(29-4)24(31-16(3)27)20-18-12-9-13-19(32-17-10-7-6-8-11-17)22(18)26(21(14)20)25(28)30-5/h6-12,18-19,22H,13H2,1-5H3/t18-,19+,22+/m0/s1