N-(4-chlorophenyl)-2-methyl-1-[(4-nitrophenyl)amino]-4,5,6,7-tetrahydroindole-3-carboxamide

Systemtic Name: N-(4-chlorophenyl)-2-methyl-1-[(4-nitrophenyl)amino]-4,5,6,7-tetrahydroindole-3-carboxamide Openeye Name: N-(4-chlorophenyl)-2-methyl-1-(4-nitroanilino)-4,5,6,7-tetrahydroindole-3-carboxamide CAS Name: N-(4-chlorophenyl)-2-methyl-1-(4-nitroanilino)-4,5,6,7-tetrahydroindole-3-carboxamide IUPAC Name: N-(4-chlorophenyl)-2-methyl-1-(4-nitroanilino)-4,5,6,7-tetrahydroindole-3-carboxamide Traditional Name: N-(4-chlorophenyl)-2-methyl-1-(4-nitroanilino)-4,5,6,7-tetrahydroindole-3-carboxamide Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1NC3=CC=C(C=C3)[N+](=O)[O-])CCCC2)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C2=C(N1NC3=CC=C(C=C3)[N+](=O)[O-])CCCC2)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN4O3/c1-14-21(22(28)24-16-8-6-15(23)7-9-16)19-4-2-3-5-20(19)26(14)25-17-10-12-18(13-11-17)27(29)30/h6-13,25H,2-5H2,1H3,(H,24,28)