propyl 3-(ethylamino)-1-phenyl-isoquinoline-4-carboxylate

Systemtic Name: propyl 3-(ethylamino)-1-phenyl-isoquinoline-4-carboxylate Openeye Name: propyl 3-(ethylamino)-1-phenyl-isoquinoline-4-carboxylate CAS Name: 3-(ethylamino)-1-phenyl-4-isoquinolinecarboxylic acid propyl ester IUPAC Name: propyl 3-(ethylamino)-1-phenylisoquinoline-4-carboxylate Traditional Name: 3-(ethylamino)-1-phenyl-isoquinoline-4-carboxylic acid propyl ester Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(N=C(C2=CC=CC=C21)C3=CC=CC=C3)NCC

Isomeric SMILES

CCCOC(=O)C1=C(N=C(C2=CC=CC=C21)C3=CC=CC=C3)NCC

InChI

InChI=1S/C21H22N2O2/c1-3-14-25-21(24)18-16-12-8-9-13-17(16)19(23-20(18)22-4-2)15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3,(H,22,23)