N-butyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide

Systemtic Name: N-butyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide Openeye Name: N-butyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide CAS Name: N-butyl-2-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: N-butyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]benzamide Traditional Name: N-butyl-2-[[(E)-3-(4-nitrophenyl)acryloyl]amino]benzamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4/c1-2-3-14-21-20(25)17-6-4-5-7-18(17)22-19(24)13-10-15-8-11-16(12-9-15)23(26)27/h4-13H,2-3,14H2,1H3,(H,21,25)(H,22,24)/b13-10+