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

Systemtic Name: (E)-1-(azepan-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(2-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(2-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=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O3/c18-15(16-11-5-1-2-6-12-16)10-9-13-7-3-4-8-14(13)17(19)20/h3-4,7-10H,1-2,5-6,11-12H2/b10-9+