5-methyl-6-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]-3-phenyl-furo[3,2-g]chromen-7-one

Systemtic Name: 5-methyl-6-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]-3-phenyl-furo[3,2-g]chromen-7-one Openeye Name: 5-methyl-6-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]-3-phenyl-furo[3,2-g]chromen-7-one CAS Name: 5-methyl-6-[3-oxo-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]propyl]-3-phenyl-7-furo[3,2-g][1]benzopyranone IUPAC Name: 5-methyl-6-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]-3-phenylfuro[3,2-g]chromen-7-one Traditional Name: 6-[3-keto-3-(4-pyridin-1-ium-2-ylpiperazino)propyl]-5-methyl-3-phenyl-furo[3,2-g]chromen-7-one Formula: C30H28N3O4+ MolecularWeight: 494.56102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=CC=C4)CCC(=O)N5CCN(CC5)C6=CC=CC=[NH+]6

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=CC=C4)CCC(=O)N5CCN(CC5)C6=CC=CC=[NH+]6

InChI

InChI=1S/C30H27N3O4/c1-20-22(10-11-29(34)33-15-13-32(14-16-33)28-9-5-6-12-31-28)30(35)37-27-18-26-24(17-23(20)27)25(19-36-26)21-7-3-2-4-8-21/h2-9,12,17-19H,10-11,13-16H2,1H3/p+1