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

Systemtic Name: N-[3-[(2,4-dimethylphenyl)methyl-methyl-amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[(2,4-dimethylphenyl)methyl-methyl-amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[(2,4-dimethylphenyl)methyl-methylamino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[(2,4-dimethylphenyl)methyl-methylamino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[(2,4-dimethylbenzyl)-methyl-amino]-3-keto-propyl]-4-nitro-benzamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c1-14-4-5-17(15(2)12-14)13-22(3)19(24)10-11-21-20(25)16-6-8-18(9-7-16)23(26)27/h4-9,12H,10-11,13H2,1-3H3,(H,21,25)