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

Systemtic Name: 4-chloranyl-N-[2-[[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-benzamide Openeye Name: 4-chloro-N-[2-[[2-(4-methylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]-3-nitro-N-propyl-benzamide CAS Name: 4-chloro-N-[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-3-nitro-N-propylbenzamide IUPAC Name: 4-chloro-N-[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-3-nitro-N-propylbenzamide Traditional Name: 4-chloro-N-[2-keto-2-[[2-keto-2-(p-toluidino)ethyl]amino]ethyl]-3-nitro-N-propyl-benzamide Formula: C21H23ClN4O5 MolecularWeight: 446.88412

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NCC(=O)NC1=CC=C(C=C1)C)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)NCC(=O)NC1=CC=C(C=C1)C)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O5/c1-3-10-25(21(29)15-6-9-17(22)18(11-15)26(30)31)13-20(28)23-12-19(27)24-16-7-4-14(2)5-8-16/h4-9,11H,3,10,12-13H2,1-2H3,(H,23,28)(H,24,27)