N-[(E)-1-(4-hydroxyphenyl)-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(E)-1-(4-hydroxyphenyl)-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(E)-2-(4-hydroxyphenyl)-1-(2-pyridylcarbamoyl)vinyl]-3-nitro-benzamide CAS Name: N-[(E)-1-(4-hydroxyphenyl)-3-oxo-3-(2-pyridinylamino)prop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(E)-1-(4-hydroxyphenyl)-3-oxo-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(E)-2-(4-hydroxyphenyl)-1-(2-pyridylcarbamoyl)vinyl]-3-nitro-benzamide Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=O)C(=CC2=CC=C(C=C2)O)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)NC(=O)/C(=C\C2=CC=C(C=C2)O)/NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O5/c26-17-9-7-14(8-10-17)12-18(21(28)24-19-6-1-2-11-22-19)23-20(27)15-4-3-5-16(13-15)25(29)30/h1-13,26H,(H,23,27)(H,22,24,28)/b18-12+