methyl 2-(6-nitro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)-2-(phenylsulfonyl)propanoate

Systemtic Name: methyl 2-(6-nitro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)-2-(phenylsulfonyl)propanoate Openeye Name: methyl 2-(benzenesulfonyl)-2-(6-nitro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)propanoate CAS Name: 2-(benzenesulfonyl)-2-(6-nitro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)propanoic acid methyl ester IUPAC Name: methyl 2-(benzenesulfonyl)-2-(6-nitro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)propanoate Traditional Name: 2-besyl-2-(6-nitro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)propionic acid methyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC2=C(C1)NC3=C2C=C(C=C3)[N+](=O)[O-])(C(=O)OC)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C1CCC2=C(C1)NC3=C2C=C(C=C3)[N+](=O)[O-])(C(=O)OC)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O6S/c1-22(21(25)30-2,31(28,29)16-6-4-3-5-7-16)14-8-10-17-18-13-15(24(26)27)9-11-19(18)23-20(17)12-14/h3-7,9,11,13-14,23H,8,10,12H2,1-2H3