methyl 1-(4-ethanoylpiperazin-1-yl)isoquinoline-3-carboxylate

Systemtic Name: methyl 1-(4-ethanoylpiperazin-1-yl)isoquinoline-3-carboxylate Openeye Name: methyl 1-(4-acetylpiperazin-1-yl)isoquinoline-3-carboxylate CAS Name: 1-(4-acetyl-1-piperazinyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-acetylpiperazin-1-yl)isoquinoline-3-carboxylate Traditional Name: 1-(4-acetylpiperazino)isoquinoline-3-carboxylic acid methyl ester Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C17H19N3O3/c1-12(21)19-7-9-20(10-8-19)16-14-6-4-3-5-13(14)11-15(18-16)17(22)23-2/h3-6,11H,7-10H2,1-2H3