7-methoxy-4-methyl-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]chromen-2-one

Systemtic Name: 7-methoxy-4-methyl-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]chromen-2-one Openeye Name: 7-methoxy-4-methyl-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]chromen-2-one CAS Name: 7-methoxy-4-methyl-3-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-methyl-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]chromen-2-one Traditional Name: 3-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]-7-methoxy-4-methyl-coumarin Formula: C19H25N2O4+ MolecularWeight: 345.4128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H24N2O4/c1-13-15-5-4-14(24-3)12-17(15)25-19(23)16(13)6-7-18(22)21-10-8-20(2)9-11-21/h4-5,12H,6-11H2,1-3H3/p+1