N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: [2-(1H-indol-3-yl)-2-phenyl-ethyl]-(4-mesyl-2-nitro-phenyl)amine Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CC=C2)C3=CNC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CC=C2)C3=CNC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O4S/c1-31(29,30)17-11-12-22(23(13-17)26(27)28)25-14-19(16-7-3-2-4-8-16)20-15-24-21-10-6-5-9-18(20)21/h2-13,15,19,24-25H,14H2,1H3