methyl 4-chloranyl-6,7,11,12,16,17-hexahydrocyclopenta[a]phenanthrene-13-carboxylate

Systemtic Name: methyl 4-chloranyl-6,7,11,12,16,17-hexahydrocyclopenta[a]phenanthrene-13-carboxylate Openeye Name: methyl 4-chloro-6,7,11,12,16,17-hexahydrocyclopenta[a]phenanthrene-13-carboxylate CAS Name: 4-chloro-6,7,11,12,16,17-hexahydrocyclopenta[a]phenanthrene-13-carboxylic acid methyl ester IUPAC Name: methyl 4-chloro-6,7,11,12,16,17-hexahydrocyclopenta[a]phenanthrene-13-carboxylate Traditional Name: 4-chloro-6,7,11,12,16,17-hexahydrocyclopenta[a]phenanthrene-13-carboxylic acid methyl ester Formula: C19H19ClO2 MolecularWeight: 314.80596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CCC=C1C3=C(CC2)C4=C(CC3)C(=CC=C4)Cl

Isomeric SMILES

COC(=O)C12CCC=C1C3=C(CC2)C4=C(CC3)C(=CC=C4)Cl

InChI

InChI=1S/C19H19ClO2/c1-22-18(21)19-10-3-5-16(19)14-7-8-15-12(13(14)9-11-19)4-2-6-17(15)20/h2,4-6H,3,7-11H2,1H3