1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl 1-benzofuran-2-carboxylate hydrochloride

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl 1-benzofuran-2-carboxylate hydrochloride Openeye Name: [2-(4-benzylpiperazin-1-yl)-1-methyl-ethyl] benzofuran-2-carboxylate hydrochloride CAS Name: 2-benzofurancarboxylic acid 1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl ester hydrochloride IUPAC Name: 1-(4-benzylpiperazin-1-yl)propan-2-yl 1-benzofuran-2-carboxylate hydrochloride Traditional Name: coumarilic acid [2-(4-benzylpiperazino)-1-methyl-ethyl] ester hydrochloride Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)CC2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4O3.Cl

Isomeric SMILES

CC(CN1CCN(CC1)CC2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4O3.Cl

InChI

InChI=1S/C23H26N2O3.ClH/c1-18(27-23(26)22-15-20-9-5-6-10-21(20)28-22)16-24-11-13-25(14-12-24)17-19-7-3-2-4-8-19;/h2-10,15,18H,11-14,16-17H2,1H3;1H