ethyl 4-(isoquinolin-1-ylmethylamino)benzoate

Systemtic Name: ethyl 4-(isoquinolin-1-ylmethylamino)benzoate Openeye Name: ethyl 4-(1-isoquinolylmethylamino)benzoate CAS Name: 4-(1-isoquinolinylmethylamino)benzoic acid ethyl ester IUPAC Name: ethyl 4-(isoquinolin-1-ylmethylamino)benzoate Traditional Name: 4-(1-isoquinolylmethylamino)benzoic acid ethyl ester Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCC2=NC=CC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C19H18N2O2/c1-2-23-19(22)15-7-9-16(10-8-15)21-13-18-17-6-4-3-5-14(17)11-12-20-18/h3-12,21H,2,13H2,1H3