N-cyclopropyl-2-[4-[3-(3-methoxyphenyl)-1-(4-methylphenyl)pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[3-(3-methoxyphenyl)-1-(4-methylphenyl)pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[3-(3-methoxyphenyl)-1-(p-tolyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[3-(3-methoxyphenyl)-1-(4-methylphenyl)-4-pyrazolyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[3-(3-methoxyphenyl)-1-(4-methylphenyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[3-(3-methoxyphenyl)-1-(p-tolyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C27H32N5O3+ MolecularWeight: 474.57468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OC)C(=O)N4CC[NH+](CC4)CC(=O)NC5CC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OC)C(=O)N4CC[NH+](CC4)CC(=O)NC5CC5

InChI

InChI=1S/C27H31N5O3/c1-19-6-10-22(11-7-19)32-17-24(26(29-32)20-4-3-5-23(16-20)35-2)27(34)31-14-12-30(13-15-31)18-25(33)28-21-8-9-21/h3-7,10-11,16-17,21H,8-9,12-15,18H2,1-2H3,(H,28,33)/p+1