propan-2-yl 2-(isoquinolin-1-ylmethyl)-3-oxidanylidene-3-phenyl-propanoate

Systemtic Name: propan-2-yl 2-(isoquinolin-1-ylmethyl)-3-oxidanylidene-3-phenyl-propanoate Openeye Name: isopropyl 2-(1-isoquinolylmethyl)-3-oxo-3-phenyl-propanoate CAS Name: 2-(1-isoquinolinylmethyl)-3-oxo-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(isoquinolin-1-ylmethyl)-3-oxo-3-phenylpropanoate Traditional Name: 2-(1-isoquinolylmethyl)-3-keto-3-phenyl-propionic acid isopropyl ester Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC1=NC=CC2=CC=CC=C21)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C(CC1=NC=CC2=CC=CC=C21)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO3/c1-15(2)26-22(25)19(21(24)17-9-4-3-5-10-17)14-20-18-11-7-6-8-16(18)12-13-23-20/h3-13,15,19H,14H2,1-2H3