[13-methyl-17-(phenylcarbamoyl)-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] sulfamate

Systemtic Name: [13-methyl-17-(phenylcarbamoyl)-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] sulfamate Openeye Name: [13-methyl-17-(phenylcarbamoyl)-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] sulfamate CAS Name: sulfamic acid [17-[anilino(oxo)methyl]-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [13-methyl-17-(phenylcarbamoyl)-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] sulfamate Traditional Name: sulfamic acid [13-methyl-17-(phenylcarbamoyl)-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] ester Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CC=C2C(=O)NC4=CC=CC=C4)CCC5=C3C=CC(=C5)OS(=O)(=O)N

Isomeric SMILES

CC12CCC3C(C1CC=C2C(=O)NC4=CC=CC=C4)CCC5=C3C=CC(=C5)OS(=O)(=O)N

InChI

InChI=1S/C25H28N2O4S/c1-25-14-13-20-19-10-8-18(31-32(26,29)30)15-16(19)7-9-21(20)22(25)11-12-23(25)24(28)27-17-5-3-2-4-6-17/h2-6,8,10,12,15,20-22H,7,9,11,13-14H2,1H3,(H,27,28)(H2,26,29,30)