6-methoxy-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-chromen-2-one

Systemtic Name: 6-methoxy-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-chromen-2-one Openeye Name: 6-methoxy-3-(4-methylpiperazin-4-ium-1-carbonyl)chromen-2-one CAS Name: 6-methoxy-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6-methoxy-3-(4-methylpiperazin-4-ium-1-carbonyl)chromen-2-one Traditional Name: 6-methoxy-3-(4-methylpiperazin-4-ium-1-carbonyl)coumarin Formula: C16H19N2O4+ MolecularWeight: 303.33306

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC3=C(C=CC(=C3)OC)OC2=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC3=C(C=CC(=C3)OC)OC2=O

InChI

InChI=1S/C16H18N2O4/c1-17-5-7-18(8-6-17)15(19)13-10-11-9-12(21-2)3-4-14(11)22-16(13)20/h3-4,9-10H,5-8H2,1-2H3/p+1