3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]propanamide

Systemtic Name: 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]propanamide Openeye Name: 3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]propanamide CAS Name: 3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-N-[[1-(4-methyl-1-piperazin-1-iumyl)cyclohexyl]methyl]propanamide IUPAC Name: 3-(7-methoxy-4-methyl-2-oxochromen-3-yl)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]propanamide Traditional Name: 3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]propionamide Formula: C26H38N3O4+ MolecularWeight: 456.59762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC3(CCCCC3)[NH+]4CCN(CC4)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC3(CCCCC3)[NH+]4CCN(CC4)C

InChI

InChI=1S/C26H37N3O4/c1-19-21-8-7-20(32-3)17-23(21)33-25(31)22(19)9-10-24(30)27-18-26(11-5-4-6-12-26)29-15-13-28(2)14-16-29/h7-8,17H,4-6,9-16,18H2,1-3H3,(H,27,30)/p+1