(Z)-2-[(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]-2-oxidanyl-ethenediazonium

Systemtic Name: (Z)-2-[(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]-2-oxidanyl-ethenediazonium Openeye Name: (Z)-2-[(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]-2-hydroxy-ethenediazonium CAS Name: (Z)-2-[(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]-2-hydroxyethenediazonium IUPAC Name: (Z)-2-[(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]-2-hydroxyethenediazonium Traditional Name: (Z)-2-[(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]-2-hydroxy-ethenediazonium Formula: C22H37N2O2+ MolecularWeight: 361.54138

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C22H36N2O2/c1-20(2,3)26-17-8-11-22(5)16(12-17)7-6-15-13-21(4,10-9-18(15)22)19(25)14-24-23/h14-18H,6-13H2,1-5H3/p+1/b19-14-/t15?,16-,17+,18?,21-,22-/m0/s1