1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea CAS Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea IUPAC Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea Traditional Name: 1-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-veratryl-urea Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2)OC

InChI

InChI=1S/C26H27N3O4/c1-32-23-11-8-18(14-24(23)33-2)16-27-26(31)28-22-10-9-19-12-13-29(17-21(19)15-22)25(30)20-6-4-3-5-7-20/h3-11,14-15H,12-13,16-17H2,1-2H3,(H2,27,28,31)