3-[[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]amino]indol-2-one

Systemtic Name: 3-[[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]amino]indol-2-one Openeye Name: 3-[[4-(p-tolylmethyl)piperazin-4-ium-1-yl]amino]indol-2-one CAS Name: 3-[[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]amino]-2-indolone IUPAC Name: 3-[[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]amino]indol-2-one Traditional Name: 3-[[4-(4-methylbenzyl)piperazin-4-ium-1-yl]amino]indol-2-one Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)NC3=C4C=CC=CC4=NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)NC3=C4C=CC=CC4=NC3=O

InChI

InChI=1S/C20H22N4O/c1-15-6-8-16(9-7-15)14-23-10-12-24(13-11-23)22-19-17-4-2-3-5-18(17)21-20(19)25/h2-9H,10-14H2,1H3,(H,21,22,25)/p+1