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

Systemtic Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-[(4-nitrophenyl)amino]ethyl]-2,3-dihydroindole-5-carboxamide Openeye Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(4-nitroanilino)ethyl]indoline-5-carboxamide CAS Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(4-nitroanilino)ethyl]-2,3-dihydroindole-5-carboxamide IUPAC Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(4-nitroanilino)ethyl]-2,3-dihydroindole-5-carboxamide Traditional Name: (2S)-1-mesyl-2-methyl-N-[2-(4-nitroanilino)ethyl]indoline-5-carboxamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-13-11-15-12-14(3-8-18(15)22(13)29(2,27)28)19(24)21-10-9-20-16-4-6-17(7-5-16)23(25)26/h3-8,12-13,20H,9-11H2,1-2H3,(H,21,24)/t13-/m0/s1