N-[(E)-1-(4-methoxyphenyl)-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[(E)-1-(4-methoxyphenyl)-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[(E)-2-(4-methoxyphenyl)-1-(2-pyridylcarbamoyl)vinyl]-3,5-dinitro-benzamide CAS Name: N-[(E)-1-(4-methoxyphenyl)-3-oxo-3-(2-pyridinylamino)prop-1-en-2-yl]-3,5-dinitrobenzamide IUPAC Name: N-[(E)-1-(4-methoxyphenyl)-3-oxo-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[(E)-2-(4-methoxyphenyl)-1-(2-pyridylcarbamoyl)vinyl]-3,5-dinitro-benzamide Formula: C22H17N5O7 MolecularWeight: 463.39968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C(=O)NC2=CC=CC=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C(=O)NC2=CC=CC=N2)/NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O7/c1-34-18-7-5-14(6-8-18)10-19(22(29)25-20-4-2-3-9-23-20)24-21(28)15-11-16(26(30)31)13-17(12-15)27(32)33/h2-13H,1H3,(H,24,28)(H,23,25,29)/b19-10+