N-[1-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-3-oxidanylidene-3-(prop-2-enylamino)prop-1-en-2-yl]benzamide

Systemtic Name: N-[1-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-3-oxidanylidene-3-(prop-2-enylamino)prop-1-en-2-yl]benzamide Openeye Name: N-[1-(allylcarbamoyl)-2-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]vinyl]benzamide CAS Name: N-[1-[3-(3-nitrophenyl)-1-phenyl-4-pyrazolyl]-3-oxo-3-(prop-2-enylamino)prop-1-en-2-yl]benzamide IUPAC Name: N-[1-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]-3-oxo-3-(prop-2-enylamino)prop-1-en-2-yl]benzamide Traditional Name: N-[1-(allylcarbamoyl)-2-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]vinyl]benzamide Formula: C28H23N5O4 MolecularWeight: 493.51332

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C=CCNC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H23N5O4/c1-2-16-29-28(35)25(30-27(34)20-10-5-3-6-11-20)18-22-19-32(23-13-7-4-8-14-23)31-26(22)21-12-9-15-24(17-21)33(36)37/h2-15,17-19H,1,16H2,(H,29,35)(H,30,34)