1-[(4-methoxyphenyl)methyl]-7-[(4-methylphenyl)sulfonylmethyl]-6-nitro-indole

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-7-[(4-methylphenyl)sulfonylmethyl]-6-nitro-indole Openeye Name: 1-[(4-methoxyphenyl)methyl]-6-nitro-7-(p-tolylsulfonylmethyl)indole CAS Name: 1-[(4-methoxyphenyl)methyl]-7-[(4-methylphenyl)sulfonylmethyl]-6-nitroindole IUPAC Name: 1-[(4-methoxyphenyl)methyl]-7-[(4-methylphenyl)sulfonylmethyl]-6-nitroindole Traditional Name: 6-nitro-1-p-anisyl-7-(tosylmethyl)indole Formula: C24H22N2O5S MolecularWeight: 450.50688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC3=C2N(C=C3)CC4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC3=C2N(C=C3)CC4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C24H22N2O5S/c1-17-3-10-21(11-4-17)32(29,30)16-22-23(26(27)28)12-7-19-13-14-25(24(19)22)15-18-5-8-20(31-2)9-6-18/h3-14H,15-16H2,1-2H3