N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-2-nitro-benzamide hydrochloride

Systemtic Name: N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-2-nitro-benzamide hydrochloride Openeye Name: N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-2-nitro-benzamide hydrochloride CAS Name: N-[[4-[(2-aminoanilino)-oxomethyl]phenyl]methyl]-2-nitrobenzamide hydrochloride IUPAC Name: N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-2-nitrobenzamide hydrochloride Traditional Name: N-[4-[(2-aminophenyl)carbamoyl]benzyl]-2-nitro-benzamide hydrochloride Formula: C21H19ClN4O4 MolecularWeight: 426.85296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)[N+](=O)[O-].Cl

InChI

InChI=1S/C21H18N4O4.ClH/c22-17-6-2-3-7-18(17)24-20(26)15-11-9-14(10-12-15)13-23-21(27)16-5-1-4-8-19(16)25(28)29;/h1-12H,13,22H2,(H,23,27)(H,24,26);1H