(E)-N-[(Z)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[(Z)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[(Z)-1-(azepane-1-carbonyl)-2-(3-nitrophenyl)vinyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[(Z)-3-(1-azepanyl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[(Z)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(Z)-1-(azepane-1-carbonyl)-2-(3-nitrophenyl)vinyl]-3-phenyl-acrylamide Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H25N3O4/c28-23(14-13-19-9-4-3-5-10-19)25-22(24(29)26-15-6-1-2-7-16-26)18-20-11-8-12-21(17-20)27(30)31/h3-5,8-14,17-18H,1-2,6-7,15-16H2,(H,25,28)/b14-13+,22-18-