4-(2-azanylethylamino)-N-(3-chloranyl-4-methyl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-(2-azanylethylamino)-N-(3-chloranyl-4-methyl-phenyl)-3-nitro-benzamide Openeye Name: 4-(2-aminoethylamino)-N-(3-chloro-4-methyl-phenyl)-3-nitro-benzamide CAS Name: 4-(2-aminoethylamino)-N-(3-chloro-4-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-(2-aminoethylamino)-N-(3-chloro-4-methylphenyl)-3-nitrobenzamide Traditional Name: 4-(2-aminoethylamino)-N-(3-chloro-4-methyl-phenyl)-3-nitro-benzamide Formula: C16H17ClN4O3 MolecularWeight: 348.78418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCCN)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCCN)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O3/c1-10-2-4-12(9-13(10)17)20-16(22)11-3-5-14(19-7-6-18)15(8-11)21(23)24/h2-5,8-9,19H,6-7,18H2,1H3,(H,20,22)