[(3R,8R,9S,10R,13S,14S,17S)-3-azaniumyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]azanium dichloride

Systemtic Name: [(3R,8R,9S,10R,13S,14S,17S)-3-azaniumyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]azanium dichloride Openeye Name: [(3R,8R,9S,10R,13S,14S,17S)-3-azaniumyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ammonium dichloride CAS Name: [(3R,8R,9S,10R,13S,14S,17S)-3-ammonio-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ammonium dichloride IUPAC Name: [(3R,8R,9S,10R,13S,14S,17S)-3-azaniumyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]azanium dichloride Traditional Name: [(3R,8R,9S,10R,13S,14S,17S)-3-ammonio-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ammonium dichloride Formula: C19H34Cl2N2 MolecularWeight: 361.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2[NH3+])CC=C4C3(CCC(C4)[NH3+])C.[Cl-].[Cl-]

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2[NH3+])CC=C4[C@@]3(CC[C@H](C4)[NH3+])C.[Cl-].[Cl-]

InChI

InChI=1S/C19H32N2.2ClH/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;;/h3,13-17H,4-11,20-21H2,1-2H3;2*1H/t13-,14+,15+,16+,17+,18+,19+;;/m1../s1