1-(methylamino)-1-phenylazanyl-3,3-bis(pyridin-4-ylmethyl)indol-1-ium-2-one

Systemtic Name: 1-(methylamino)-1-phenylazanyl-3,3-bis(pyridin-4-ylmethyl)indol-1-ium-2-one Openeye Name: 1-anilino-1-(methylamino)-3,3-bis(4-pyridylmethyl)indolin-1-ium-2-one CAS Name: 1-anilino-1-(methylamino)-3,3-bis(pyridin-4-ylmethyl)-2-indol-1-iumone IUPAC Name: 1-anilino-1-(methylamino)-3,3-bis(pyridin-4-ylmethyl)indol-1-ium-2-one Traditional Name: 1-anilino-1-(methylamino)-3,3-bis(4-pyridylmethyl)indolin-1-ium-2-one Formula: C27H26N5O+ MolecularWeight: 436.52824

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+]1(C2=CC=CC=C2C(C1=O)(CC3=CC=NC=C3)CC4=CC=NC=C4)NC5=CC=CC=C5

Isomeric SMILES

CN[N+]1(C2=CC=CC=C2C(C1=O)(CC3=CC=NC=C3)CC4=CC=NC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C27H26N5O/c1-28-32(31-23-7-3-2-4-8-23)25-10-6-5-9-24(25)27(26(32)33,19-21-11-15-29-16-12-21)20-22-13-17-30-18-14-22/h2-18,28,31H,19-20H2,1H3/q+1