phenyl 3-(3-methoxy-1-propanoyl-3,4-dihydro-1H-isoquinolin-2-yl)propanoate

Systemtic Name: phenyl 3-(3-methoxy-1-propanoyl-3,4-dihydro-1H-isoquinolin-2-yl)propanoate Openeye Name: phenyl 3-(3-methoxy-1-propanoyl-3,4-dihydro-1H-isoquinolin-2-yl)propanoate CAS Name: 3-[3-methoxy-1-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-2-yl]propanoic acid phenyl ester IUPAC Name: phenyl 3-(3-methoxy-1-propanoyl-3,4-dihydro-1H-isoquinolin-2-yl)propanoate Traditional Name: 3-(3-methoxy-1-propionyl-3,4-dihydro-1H-isoquinolin-2-yl)propionic acid phenyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C2=CC=CC=C2CC(N1CCC(=O)OC3=CC=CC=C3)OC

Isomeric SMILES

CCC(=O)C1C2=CC=CC=C2CC(N1CCC(=O)OC3=CC=CC=C3)OC

InChI

InChI=1S/C22H25NO4/c1-3-19(24)22-18-12-8-7-9-16(18)15-20(26-2)23(22)14-13-21(25)27-17-10-5-4-6-11-17/h4-12,20,22H,3,13-15H2,1-2H3