phenyl 1-(2-methoxycarbonylprop-2-enyl)-1H-isoquinoline-2-carboxylate

Systemtic Name: phenyl 1-(2-methoxycarbonylprop-2-enyl)-1H-isoquinoline-2-carboxylate Openeye Name: phenyl 1-(2-methoxycarbonylallyl)-1H-isoquinoline-2-carboxylate CAS Name: 1-(2-methoxycarbonylprop-2-enyl)-1H-isoquinoline-2-carboxylic acid phenyl ester IUPAC Name: phenyl 1-(2-methoxycarbonylprop-2-enyl)-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-carbomethoxyallyl)-1H-isoquinoline-2-carboxylic acid phenyl ester Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)CC1C2=CC=CC=C2C=CN1C(=O)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(=C)CC1C2=CC=CC=C2C=CN1C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4/c1-15(20(23)25-2)14-19-18-11-7-6-8-16(18)12-13-22(19)21(24)26-17-9-4-3-5-10-17/h3-13,19H,1,14H2,2H3