(E)-1-[4-(azepan-1-yl)phenyl]-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(azepan-1-yl)phenyl]-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(azepan-1-yl)phenyl]-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(1-azepanyl)phenyl]-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(azepan-1-yl)phenyl]-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(azepan-1-yl)phenyl]-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-en-1-one Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C=CC(=O)C2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)/C=C/C(=O)C2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C23H27NO4/c1-27-21-15-17(16-22(28-2)23(21)26)7-12-20(25)18-8-10-19(11-9-18)24-13-5-3-4-6-14-24/h7-12,15-16,26H,3-6,13-14H2,1-2H3/b12-7+