1-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-methylphenyl)-3-oxidanylidene-propyl]urea

Systemtic Name: 1-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-methylphenyl)-3-oxidanylidene-propyl]urea Openeye Name: [3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(o-tolyl)-3-oxo-propyl]urea CAS Name: [3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-methylphenyl)-3-oxopropyl]urea IUPAC Name: [3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-methylphenyl)-3-oxopropyl]urea Traditional Name: [3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-1-(o-tolyl)propyl]urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)NC(=O)N

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)NC(=O)N

InChI

InChI=1S/C22H27N3O4/c1-14-6-4-5-7-17(14)18(24-22(23)27)12-21(26)25-9-8-15-10-19(28-2)20(29-3)11-16(15)13-25/h4-7,10-11,18H,8-9,12-13H2,1-3H3,(H3,23,24,27)