3-(3,5-dimethylphenyl)imino-1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]indol-2-one

Systemtic Name: 3-(3,5-dimethylphenyl)imino-1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]indol-2-one Openeye Name: 3-(3,5-dimethylphenyl)imino-1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]indolin-2-one CAS Name: 3-(3,5-dimethylphenyl)imino-1-[[(3R)-3-methyl-1-piperidin-1-iumyl]methyl]-2-indolone IUPAC Name: 3-(3,5-dimethylphenyl)imino-1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]indol-2-one Traditional Name: 3-(3,5-dimethylphenyl)imino-1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]oxindole Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CN2C3=CC=CC=C3C(=NC4=CC(=CC(=C4)C)C)C2=O

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CN2C3=CC=CC=C3C(=NC4=CC(=CC(=C4)C)C)C2=O

InChI

InChI=1S/C23H27N3O/c1-16-7-6-10-25(14-16)15-26-21-9-5-4-8-20(21)22(23(26)27)24-19-12-17(2)11-18(3)13-19/h4-5,8-9,11-13,16H,6-7,10,14-15H2,1-3H3/p+1/t16-/m1/s1