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

Systemtic Name: 2,5-dimethyl-6-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-3-phenyl-furo[3,2-g]chromen-7-one Openeye Name: 2,5-dimethyl-6-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]-3-phenyl-furo[3,2-g]chromen-7-one CAS Name: 2,5-dimethyl-6-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]-3-phenyl-7-furo[3,2-g][1]benzopyranone IUPAC Name: 2,5-dimethyl-6-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]-3-phenylfuro[3,2-g]chromen-7-one Traditional Name: 6-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]-2,5-dimethyl-3-phenyl-furo[3,2-g]chromen-7-one Formula: C27H29N2O4+ MolecularWeight: 445.53016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CCC(=O)N5CC[NH+](CC5)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CCC(=O)N5CC[NH+](CC5)C

InChI

InChI=1S/C27H28N2O4/c1-17-20(9-10-25(30)29-13-11-28(3)12-14-29)27(31)33-23-16-24-22(15-21(17)23)26(18(2)32-24)19-7-5-4-6-8-19/h4-8,15-16H,9-14H2,1-3H3/p+1