1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]urea Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)NC1=CC2=C(C=C1)OCO2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)(CNC(=O)NC1=CC2=C(C=C1)OCO2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H25N3O3/c1-21(2,24-10-9-15-5-3-4-6-16(15)12-24)13-22-20(25)23-17-7-8-18-19(11-17)27-14-26-18/h3-8,11H,9-10,12-14H2,1-2H3,(H2,22,23,25)