4-chloranyl-N-cyclopropyl-N-[2-[[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-cyclopropyl-N-[2-[[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-cyclopropyl-N-[2-[[2-(3-methylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-cyclopropyl-N-[2-[[2-(3-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-cyclopropyl-N-[2-[[2-(3-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-cyclopropyl-N-[2-keto-2-[[2-keto-2-(m-toluidino)ethyl]amino]ethyl]-3-nitro-benzamide Formula: C21H21ClN4O5 MolecularWeight: 444.86824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CNC(=O)CN(C2CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CNC(=O)CN(C2CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O5/c1-13-3-2-4-15(9-13)24-19(27)11-23-20(28)12-25(16-6-7-16)21(29)14-5-8-17(22)18(10-14)26(30)31/h2-5,8-10,16H,6-7,11-12H2,1H3,(H,23,28)(H,24,27)