N-[(Z)-3-(azepan-1-yl)-1-(4-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-1-(4-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-nitrophenyl)vinyl]benzamide CAS Name: N-[(Z)-3-(1-azepanyl)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-nitrophenyl)vinyl]benzamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4/c26-21(18-8-4-3-5-9-18)23-20(22(27)24-14-6-1-2-7-15-24)16-17-10-12-19(13-11-17)25(28)29/h3-5,8-13,16H,1-2,6-7,14-15H2,(H,23,26)/b20-16-