N-[4-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-methoxy-benzamide

Systemtic Name: N-[4-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-methoxy-benzamide Openeye Name: N-[4-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-methoxy-benzamide CAS Name: N-[4-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-methoxybenzamide IUPAC Name: N-[4-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-methoxybenzamide Traditional Name: N-(4-homoveratryl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-3-methoxy-benzamide Formula: C28H30N2O6 MolecularWeight: 490.5476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)OC)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)OC)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H30N2O6/c1-18-28(32)30(13-12-19-8-10-25(34-3)26(14-19)35-4)17-21-15-22(9-11-24(21)36-18)29-27(31)20-6-5-7-23(16-20)33-2/h5-11,14-16,18H,12-13,17H2,1-4H3,(H,29,31)