[(8R,9S,10R,13S,14S,17S)-4-chloranyl-10,13-dimethyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] nitrate

Systemtic Name: [(8R,9S,10R,13S,14S,17S)-4-chloranyl-10,13-dimethyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] nitrate Openeye Name: [(8R,9S,10R,13S,14S,17S)-4-chloro-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] nitrate CAS Name: nitric acid [(8R,9S,10R,13S,14S,17S)-4-chloro-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [(8R,9S,10R,13S,14S,17S)-4-chloro-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] nitrate Traditional Name: nitric acid [(8R,9S,10R,13S,14S,17S)-4-chloro-3-keto-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] ester Formula: C19H26ClNO4 MolecularWeight: 367.86704

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2O[N+](=O)[O-])CCC4=C(C(=O)CCC34C)Cl

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O[N+](=O)[O-])CCC4=C(C(=O)CC[C@]34C)Cl

InChI

InChI=1S/C19H26ClNO4/c1-18-10-8-15(22)17(20)14(18)4-3-11-12-5-6-16(25-21(23)24)19(12,2)9-7-13(11)18/h11-13,16H,3-10H2,1-2H3/t11-,12-,13-,16-,18+,19-/m0/s1