N-[(E)-1-(4,5-dimethoxy-2-nitro-phenyl)-3-(2-hydroxyethylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-1-(4,5-dimethoxy-2-nitro-phenyl)-3-(2-hydroxyethylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)-1-(2-hydroxyethylcarbamoyl)vinyl]benzamide CAS Name: N-[(E)-1-(4,5-dimethoxy-2-nitrophenyl)-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(4,5-dimethoxy-2-nitrophenyl)-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)-1-(2-hydroxyethylcarbamoyl)vinyl]benzamide Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C(=O)NCCO)NC(=O)C2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C(=O)NCCO)/NC(=O)C2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N3O7/c1-29-17-11-14(16(23(27)28)12-18(17)30-2)10-15(20(26)21-8-9-24)22-19(25)13-6-4-3-5-7-13/h3-7,10-12,24H,8-9H2,1-2H3,(H,21,26)(H,22,25)/b15-10+