1-methylsulfonyl-N-[2-[(4-nitrophenyl)amino]ethyl]-2,3-dihydroindole-5-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[2-[(4-nitrophenyl)amino]ethyl]-2,3-dihydroindole-5-carboxamide Openeye Name: 1-methylsulfonyl-N-[2-(4-nitroanilino)ethyl]indoline-5-carboxamide CAS Name: 1-methylsulfonyl-N-[2-(4-nitroanilino)ethyl]-2,3-dihydroindole-5-carboxamide IUPAC Name: 1-methylsulfonyl-N-[2-(4-nitroanilino)ethyl]-2,3-dihydroindole-5-carboxamide Traditional Name: 1-mesyl-N-[2-(4-nitroanilino)ethyl]indoline-5-carboxamide Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5S/c1-28(26,27)21-11-8-13-12-14(2-7-17(13)21)18(23)20-10-9-19-15-3-5-16(6-4-15)22(24)25/h2-7,12,19H,8-11H2,1H3,(H,20,23)