7-methoxy-3-piperazin-4-ium-1-ylcarbonyl-chromen-2-one

Systemtic Name: 7-methoxy-3-piperazin-4-ium-1-ylcarbonyl-chromen-2-one Openeye Name: 7-methoxy-3-(piperazin-4-ium-1-carbonyl)chromen-2-one CAS Name: 7-methoxy-3-[oxo(1-piperazin-4-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-3-(piperazin-4-ium-1-carbonyl)chromen-2-one Traditional Name: 7-methoxy-3-(piperazin-4-ium-1-carbonyl)coumarin Formula: C15H17N2O4+ MolecularWeight: 289.30648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C15H16N2O4/c1-20-11-3-2-10-8-12(15(19)21-13(10)9-11)14(18)17-6-4-16-5-7-17/h2-3,8-9,16H,4-7H2,1H3/p+1