ethyl 2-[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]ethanoate Openeye Name: ethyl 2-[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]acetate CAS Name: 2-[4-[oxo-(phenethylamino)methyl]-1H-isoquinolin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]acetate Traditional Name: 2-[4-(phenethylcarbamoyl)-1H-isoquinolin-2-yl]acetic acid ethyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CC2=CC=CC=C2C(=C1)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1CC2=CC=CC=C2C(=C1)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O3/c1-2-27-21(25)16-24-14-18-10-6-7-11-19(18)20(15-24)22(26)23-13-12-17-8-4-3-5-9-17/h3-11,15H,2,12-14,16H2,1H3,(H,23,26)