1-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl]pyridin-1-ium-3-carboxamide Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)C[N+]3=CC=CC(=C3)C(=O)N)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)C[N+]3=CC=CC(=C3)C(=O)N)C)C

InChI

InChI=1S/C20H21N3O2/c1-20(2)16-8-4-5-9-17(16)22(3)18(20)11-15(24)13-23-10-6-7-14(12-23)19(21)25/h4-12H,13H2,1-3H3,(H-,21,25)/p+1