[3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: [3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolyl]-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C24H28ClN4O+ MolecularWeight: 423.95832

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H27ClN4O/c1-2-12-27-13-15-28(16-14-27)24(30)22-18-29(17-19-6-4-3-5-7-19)26-23(22)20-8-10-21(25)11-9-20/h3-11,18H,2,12-17H2,1H3/p+1