[2-[[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]methyl]phenyl] N,N-dimethylcarbamate

Systemtic Name: [2-[[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]methyl]phenyl] N,N-dimethylcarbamate Openeye Name: [2-[[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]methyl]phenyl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [2-[[4-[oxo-(phenethylamino)methyl]-1H-isoquinolin-2-yl]methyl]phenyl] ester IUPAC Name: [2-[[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]methyl]phenyl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [2-[[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]methyl]phenyl] ester Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=CC=CC=C1CN2CC3=CC=CC=C3C(=C2)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)OC1=CC=CC=C1CN2CC3=CC=CC=C3C(=C2)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3/c1-30(2)28(33)34-26-15-9-7-13-23(26)19-31-18-22-12-6-8-14-24(22)25(20-31)27(32)29-17-16-21-10-4-3-5-11-21/h3-15,20H,16-19H2,1-2H3,(H,29,32)