(phenylmethyl) N-[2-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)ethyl]carbamate Openeye Name: benzyl N-[2-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolyl)ethyl]carbamate CAS Name: N-[2-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinyl)ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-(2,6,7-trimethyl-1-oxo-4-phenylisoquinolin-3-yl)ethyl]carbamate Traditional Name: N-[2-(1-keto-2,6,7-trimethyl-4-phenyl-3-isoquinolyl)ethyl]carbamic acid benzyl ester Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)CCNC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)CCNC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H28N2O3/c1-19-16-23-24(17-20(19)2)27(31)30(3)25(26(23)22-12-8-5-9-13-22)14-15-29-28(32)33-18-21-10-6-4-7-11-21/h4-13,16-17H,14-15,18H2,1-3H3,(H,29,32)