3-(4-phenoxyphenyl)imino-1-(piperidin-1-ium-1-ylmethyl)indol-2-one

Systemtic Name: 3-(4-phenoxyphenyl)imino-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Openeye Name: 3-(4-phenoxyphenyl)imino-1-(piperidin-1-ium-1-ylmethyl)indolin-2-one CAS Name: 3-(4-phenoxyphenyl)imino-1-(1-piperidin-1-iumylmethyl)-2-indolone IUPAC Name: 3-(4-phenoxyphenyl)imino-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Traditional Name: 3-(4-phenoxyphenyl)imino-1-(piperidin-1-ium-1-ylmethyl)oxindole Formula: C26H26N3O2+ MolecularWeight: 412.50354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C3=CC=CC=C3C(=NC4=CC=C(C=C4)OC5=CC=CC=C5)C2=O

Isomeric SMILES

C1CC[NH+](CC1)CN2C3=CC=CC=C3C(=NC4=CC=C(C=C4)OC5=CC=CC=C5)C2=O

InChI

InChI=1S/C26H25N3O2/c30-26-25(27-20-13-15-22(16-14-20)31-21-9-3-1-4-10-21)23-11-5-6-12-24(23)29(26)19-28-17-7-2-8-18-28/h1,3-6,9-16H,2,7-8,17-19H2/p+1