2-[1-[(3,4-dimethoxyphenyl)methyl]-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl]-N-(1,2-oxazol-5-ylmethyl)-2-phenyl-ethanamide

Systemtic Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl]-N-(1,2-oxazol-5-ylmethyl)-2-phenyl-ethanamide Openeye Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl]-N-(isoxazol-5-ylmethyl)-2-phenyl-acetamide CAS Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl]-N-(5-isoxazolylmethyl)-2-phenylacetamide IUPAC Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl]-N-(1,2-oxazol-5-ylmethyl)-2-phenylacetamide Traditional Name: 2-(7,8-dimethoxy-1-veratryl-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-N-(isoxazol-5-ylmethyl)-2-phenyl-acetamide Formula: C33H37N3O6 MolecularWeight: 571.66338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCCN2C(C4=CC=CC=C4)C(=O)NCC5=CC=NO5)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCCN2C(C4=CC=CC=C4)C(=O)NCC5=CC=NO5)OC)OC)OC

InChI

InChI=1S/C33H37N3O6/c1-38-28-13-12-22(18-29(28)39-2)17-27-26-20-31(41-4)30(40-3)19-24(26)11-8-16-36(27)32(23-9-6-5-7-10-23)33(37)34-21-25-14-15-35-42-25/h5-7,9-10,12-15,18-20,27,32H,8,11,16-17,21H2,1-4H3,(H,34,37)