methyl 1-[(4-propan-2-ylphenyl)amino]isoquinoline-4-carboxylate

Systemtic Name: methyl 1-[(4-propan-2-ylphenyl)amino]isoquinoline-4-carboxylate Openeye Name: methyl 1-(4-isopropylanilino)isoquinoline-4-carboxylate CAS Name: 1-(4-propan-2-ylanilino)-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-propan-2-ylanilino)isoquinoline-4-carboxylate Traditional Name: 1-cumidinoisoquinoline-4-carboxylic acid methyl ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C20H20N2O2/c1-13(2)14-8-10-15(11-9-14)22-19-17-7-5-4-6-16(17)18(12-21-19)20(23)24-3/h4-13H,1-3H3,(H,21,22)