[2,4-bis(oxidanylidene)-1H-quinolin-3-ylidene]-(3-piperidin-1-ium-1-ylpropylamino)methanolate

Systemtic Name: [2,4-bis(oxidanylidene)-1H-quinolin-3-ylidene]-(3-piperidin-1-ium-1-ylpropylamino)methanolate Openeye Name: (2,4-dioxo-1H-quinolin-3-ylidene)-(3-piperidin-1-ium-1-ylpropylamino)methanolate CAS Name: (2,4-dioxo-1H-quinolin-3-ylidene)-[3-(1-piperidin-1-iumyl)propylamino]methanolate IUPAC Name: (2,4-dioxo-1H-quinolin-3-ylidene)-(3-piperidin-1-ium-1-ylpropylamino)methanolate Traditional Name: (2,4-diketo-1H-quinolin-3-ylidene)-(3-piperidin-1-ium-1-ylpropylamino)methanolate Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=C2C(=O)C3=CC=CC=C3NC2=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=C2C(=O)C3=CC=CC=C3NC2=O)[O-]

InChI

InChI=1S/C18H23N3O3/c22-16-13-7-2-3-8-14(13)20-18(24)15(16)17(23)19-9-6-12-21-10-4-1-5-11-21/h2-3,7-8,19,23H,1,4-6,9-12H2,(H,20,24)