1-(azepan-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: 1-(azepan-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: 1-(1-azepanyl)-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: 1-(azepan-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: 1-(azepan-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O3/c18-15(16-10-3-1-2-4-11-16)9-8-13-6-5-7-14(12-13)17(19)20/h5-9,12H,1-4,10-11H2