4-(cyclopropylamino)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-(2,4-dimethylbenzyl)-N-methyl-3-nitro-benzamide Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O3/c1-13-4-5-16(14(2)10-13)12-22(3)20(24)15-6-9-18(21-17-7-8-17)19(11-15)23(25)26/h4-6,9-11,17,21H,7-8,12H2,1-3H3