N-cyclopropyl-2-(dimethylamino)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide

Systemtic Name: N-cyclopropyl-2-(dimethylamino)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide Openeye Name: N-cyclopropyl-2-(dimethylamino)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide CAS Name: N-cyclopropyl-2-(dimethylamino)-5-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-(dimethylamino)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide Traditional Name: N-cyclopropyl-2-(dimethylamino)-5-[[(E)-3-(4-nitrophenyl)acryloyl]amino]benzamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3CC3

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4/c1-24(2)19-11-8-16(13-18(19)21(27)23-15-6-7-15)22-20(26)12-5-14-3-9-17(10-4-14)25(28)29/h3-5,8-13,15H,6-7H2,1-2H3,(H,22,26)(H,23,27)/b12-5+