(Z)-3-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]-1-diazonio-prop-1-en-2-olate

Systemtic Name: (Z)-3-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]-1-diazonio-prop-1-en-2-olate Openeye Name: (Z)-3-[(2S,4bS,7R,8aS)-7-tert-butoxy-2,4b-dimethyl-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]-1-diazonio-prop-1-en-2-olate CAS Name: (Z)-3-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]-1-diazonio-1-propen-2-olate IUPAC Name: (Z)-3-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]-1-diazonioprop-1-en-2-olate Traditional Name: (Z)-3-[(2S,4bS,7R,8aS)-7-tert-butoxy-2,4b-dimethyl-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]-1-diazonio-prop-1-en-2-olate Formula: C23H38N2O2 MolecularWeight: 374.56002

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2C(C1)CCC3C2(CCC(C3)OC(C)(C)C)C)CC(=C[N+]#N)[O-]

Isomeric SMILES

C[C@@]1(CCC2C(C1)CC[C@@H]3[C@@]2(CC[C@H](C3)OC(C)(C)C)C)C/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C23H38N2O2/c1-21(2,3)27-19-8-11-23(5)17(12-19)7-6-16-13-22(4,10-9-20(16)23)14-18(26)15-25-24/h15-17,19-20H,6-14H2,1-5H3/b18-15-/t16?,17-,19+,20?,22-,23-/m0/s1