N-[(Z)-3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-tert-butyl-benzamide

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-tert-butyl-benzamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(3,4-dimethoxyphenyl)vinyl]-4-tert-butyl-benzamide CAS Name: N-[(Z)-3-(1-azepanyl)-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(3,4-dimethoxyphenyl)vinyl]-4-tert-butyl-benzamide Formula: C28H36N2O4 MolecularWeight: 464.59644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=C(C=C2)OC)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=C(C=C2)OC)OC)/C(=O)N3CCCCCC3

InChI

InChI=1S/C28H36N2O4/c1-28(2,3)22-13-11-21(12-14-22)26(31)29-23(27(32)30-16-8-6-7-9-17-30)18-20-10-15-24(33-4)25(19-20)34-5/h10-15,18-19H,6-9,16-17H2,1-5H3,(H,29,31)/b23-18-