1-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-3-(4-propan-2-ylphenyl)imino-indol-2-one

Systemtic Name: 1-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-3-(4-propan-2-ylphenyl)imino-indol-2-one Openeye Name: 1-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-(4-isopropylphenyl)imino-indolin-2-one CAS Name: 1-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-3-(4-propan-2-ylphenyl)imino-2-indolone IUPAC Name: 1-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-(4-propan-2-ylphenyl)iminoindol-2-one Traditional Name: 1-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-p-cumenylimino-oxindole Formula: C30H34N3O+ MolecularWeight: 452.61046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O/c1-22(2)25-12-14-26(15-13-25)31-29-27-10-6-7-11-28(27)33(30(29)34)21-32-18-16-24(17-19-32)20-23-8-4-3-5-9-23/h3-15,22,24H,16-21H2,1-2H3/p+1