3-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)imino]-1-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]indol-2-one

Systemtic Name: 3-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)imino]-1-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]indol-2-one Openeye Name: 1-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)imino]indolin-2-one CAS Name: 3-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)imino]-1-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-2-indolone IUPAC Name: 1-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)imino]indol-2-one Traditional Name: 1-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)imino]oxindole Formula: C31H32N5O2+ MolecularWeight: 506.61808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)N=C3C4=CC=CC=C4N(C3=O)C[NH+]5CCC(CC5)CC6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)N=C3C4=CC=CC=C4N(C3=O)C[NH+]5CCC(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C31H31N5O2/c1-22-28(31(38)36(33-22)25-12-6-3-7-13-25)32-29-26-14-8-9-15-27(26)35(30(29)37)21-34-18-16-24(17-19-34)20-23-10-4-2-5-11-23/h2-15,24,33H,16-21H2,1H3/p+1