(phenylmethyl) 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbamoyloxy)benzoate

Systemtic Name: (phenylmethyl) 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbamoyloxy)benzoate Openeye Name: benzyl 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbamoyloxy)benzoate CAS Name: 4-[(3,4-dihydro-1H-isoquinolin-2-ylamino)-oxomethoxy]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbamoyloxy)benzoate Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbamoyloxy)benzoic acid benzyl ester Formula: C24H22N2O4 MolecularWeight: 402.44248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)NC(=O)OC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)NC(=O)OC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O4/c27-23(29-17-18-6-2-1-3-7-18)20-10-12-22(13-11-20)30-24(28)25-26-15-14-19-8-4-5-9-21(19)16-26/h1-13H,14-17H2,(H,25,28)