(13-methyl-17-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoate

Systemtic Name: (13-methyl-17-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoate Openeye Name: (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoate CAS Name: 2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]propanoic acid (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) ester IUPAC Name: (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoate Traditional Name: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propionic acid (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) ester Formula: C24H32ClN3O5 MolecularWeight: 477.98098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4O)C)NC(=O)N(CCCl)N=O

Isomeric SMILES

CC(C(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4O)C)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C24H32ClN3O5/c1-14(26-23(31)28(27-32)12-11-25)22(30)33-16-4-6-17-15(13-16)3-5-19-18(17)9-10-24(2)20(19)7-8-21(24)29/h4,6,13-14,18-21,29H,3,5,7-12H2,1-2H3,(H,26,31)