6-chloranyl-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)carbonyl-chromen-4-one

Systemtic Name: 6-chloranyl-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)carbonyl-chromen-4-one Openeye Name: 6-chloro-2-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)chromen-4-one CAS Name: 6-chloro-2-[oxo-[4-(4-pyridin-1-iumyl)-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 6-chloro-2-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)chromen-4-one Traditional Name: 6-chloro-2-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)chromone Formula: C19H17ClN3O3+ MolecularWeight: 370.80958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H16ClN3O3/c20-13-1-2-17-15(11-13)16(24)12-18(26-17)19(25)23-9-7-22(8-10-23)14-3-5-21-6-4-14/h1-6,11-12H,7-10H2/p+1