4-(3-methoxypropylamino)-N-(2-methylphenyl)-3-nitro-benzamide

Systemtic Name: 4-(3-methoxypropylamino)-N-(2-methylphenyl)-3-nitro-benzamide Openeye Name: 4-(3-methoxypropylamino)-3-nitro-N-(o-tolyl)benzamide CAS Name: 4-(3-methoxypropylamino)-N-(2-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-(3-methoxypropylamino)-N-(2-methylphenyl)-3-nitrobenzamide Traditional Name: 4-(3-methoxypropylamino)-3-nitro-N-(o-tolyl)benzamide Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)NCCCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)NCCCOC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4/c1-13-6-3-4-7-15(13)20-18(22)14-8-9-16(17(12-14)21(23)24)19-10-5-11-25-2/h3-4,6-9,12,19H,5,10-11H2,1-2H3,(H,20,22)