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

Systemtic Name: 1-[(3Z)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[(3Z)-2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl]pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[(3Z)-2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl]-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[(3Z)-2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[(3Z)-2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl]pyridin-1-ium-3-carboxamide chloride Formula: C20H22ClN3O2 MolecularWeight: 371.86058

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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.[Cl-]

Isomeric SMILES

CC\1(C2=CC=CC=C2N(/C1=C\C(=O)C[N+]3=CC=CC(=C3)C(=O)N)C)C.[Cl-]

InChI

InChI=1S/C20H21N3O2.ClH/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);1H/b18-11-;