tert-butyl (1S,3aS,3bS,9aR,9bS,11aS)-1-(diethylcarbamoyl)-6-ethenyl-9a,11a-dimethyl-7-oxidanylidene-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-5-carboxylate

Systemtic Name: tert-butyl (1S,3aS,3bS,9aR,9bS,11aS)-1-(diethylcarbamoyl)-6-ethenyl-9a,11a-dimethyl-7-oxidanylidene-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-5-carboxylate Openeye Name: tert-butyl (1S,3aS,3bS,9aR,9bS,11aS)-1-(diethylcarbamoyl)-9a,11a-dimethyl-7-oxo-6-vinyl-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-5-carboxylate CAS Name: (1S,3aS,3bS,9aR,9bS,11aS)-1-[diethylamino(oxo)methyl]-6-ethenyl-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,3aS,3bS,9aR,9bS,11aS)-1-(diethylcarbamoyl)-6-ethenyl-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-5-carboxylate Traditional Name: (1S,3aS,3bS,9aR,9bS,11aS)-1-(diethylcarbamoyl)-7-keto-9a,11a-dimethyl-6-vinyl-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-5-carboxylic acid tert-butyl ester Formula: C30H46N2O4 MolecularWeight: 498.69724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCC2C1(CCC3C2CN(C4=C(C(=O)CCC34C)C=C)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CN(C4=C(C(=O)CC[C@]34C)C=C)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C30H46N2O4/c1-9-19-24(33)15-17-30(8)22-14-16-29(7)21(12-13-23(29)26(34)31(10-2)11-3)20(22)18-32(25(19)30)27(35)36-28(4,5)6/h9,20-23H,1,10-18H2,2-8H3/t20-,21-,22-,23+,29-,30+/m0/s1