1-[(E)-3-(azepan-1-yl)-3-oxidanylidene-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]pyridin-2-one

Systemtic Name: 1-[(E)-3-(azepan-1-yl)-3-oxidanylidene-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]pyridin-2-one Openeye Name: 1-[(E)-1-(azepane-1-carbonyl)-2-(4-benzyloxyphenyl)vinyl]pyridin-2-one CAS Name: 1-[(E)-3-(1-azepanyl)-3-oxo-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]-2-pyridinone IUPAC Name: 1-[(E)-3-(azepan-1-yl)-3-oxo-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]pyridin-2-one Traditional Name: 1-[(E)-1-(azepane-1-carbonyl)-2-(4-benzoxyphenyl)vinyl]-2-pyridone Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC=C3)N4C=CC=CC4=O

Isomeric SMILES

C1CCCN(CC1)C(=O)/C(=C\C2=CC=C(C=C2)OCC3=CC=CC=C3)/N4C=CC=CC4=O

InChI

InChI=1S/C27H28N2O3/c30-26-12-6-9-19-29(26)25(27(31)28-17-7-1-2-8-18-28)20-22-13-15-24(16-14-22)32-21-23-10-4-3-5-11-23/h3-6,9-16,19-20H,1-2,7-8,17-18,21H2/b25-20+