[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate

Systemtic Name: [1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Openeye Name: [1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate CAS Name: 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid [1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-nitroanilino)-1-oxopropan-2-yl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Traditional Name: 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid [2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CC3=C(C=C2)NC4=C3CCCC4

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CC3=C(C=C2)NC4=C3CCCC4

InChI

InChI=1S/C22H21N3O5/c1-13(21(26)23-15-5-4-6-16(12-15)25(28)29)30-22(27)14-9-10-20-18(11-14)17-7-2-3-8-19(17)24-20/h4-6,9-13,24H,2-3,7-8H2,1H3,(H,23,26)