(4-pentan-3-ylpiperazin-1-yl)-(3-phenoxyphenyl)methanone hydrochloride

Systemtic Name: (4-pentan-3-ylpiperazin-1-yl)-(3-phenoxyphenyl)methanone hydrochloride Openeye Name: [4-(1-ethylpropyl)piperazin-1-yl]-(3-phenoxyphenyl)methanone hydrochloride CAS Name: (4-pentan-3-yl-1-piperazinyl)-(3-phenoxyphenyl)methanone hydrochloride IUPAC Name: (4-pentan-3-ylpiperazin-1-yl)-(3-phenoxyphenyl)methanone hydrochloride Traditional Name: [4-(1-ethylpropyl)piperazino]-(3-phenoxyphenyl)methanone hydrochloride Formula: C22H29ClN2O2 MolecularWeight: 388.93086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)C2=CC(=CC=C2)OC3=CC=CC=C3.Cl

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)C2=CC(=CC=C2)OC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H28N2O2.ClH/c1-3-19(4-2)23-13-15-24(16-14-23)22(25)18-9-8-12-21(17-18)26-20-10-6-5-7-11-20;/h5-12,17,19H,3-4,13-16H2,1-2H3;1H