3-azanyl-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]chromen-2-one

Systemtic Name: 3-azanyl-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]chromen-2-one Openeye Name: 3-amino-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]chromen-2-one CAS Name: 3-amino-4-[3-(4-methyl-1-piperazine-1,4-diiumyl)propylamino]-1-benzopyran-2-one IUPAC Name: 3-amino-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]chromen-2-one Traditional Name: 3-amino-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]coumarin Formula: C17H26N4O2+2 MolecularWeight: 318.41394

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNC2=C(C(=O)OC3=CC=CC=C32)N

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNC2=C(C(=O)OC3=CC=CC=C32)N

InChI

InChI=1S/C17H24N4O2/c1-20-9-11-21(12-10-20)8-4-7-19-16-13-5-2-3-6-14(13)23-17(22)15(16)18/h2-3,5-6,19H,4,7-12,18H2,1H3/p+2