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

Systemtic Name: 4-[(2,4-dimethylphenyl)methyl-methyl-amino]-3-nitro-benzamide Openeye Name: 4-[(2,4-dimethylphenyl)methyl-methyl-amino]-3-nitro-benzamide CAS Name: 4-[(2,4-dimethylphenyl)methyl-methylamino]-3-nitrobenzamide IUPAC Name: 4-[(2,4-dimethylphenyl)methyl-methylamino]-3-nitrobenzamide Traditional Name: 4-[(2,4-dimethylbenzyl)-methyl-amino]-3-nitro-benzamide Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3/c1-11-4-5-14(12(2)8-11)10-19(3)15-7-6-13(17(18)21)9-16(15)20(22)23/h4-9H,10H2,1-3H3,(H2,18,21)