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

Systemtic Name: 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propanamide Openeye Name: 3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propanamide CAS Name: 3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]propanamide IUPAC Name: 3-(7-methoxy-4-methyl-2-oxochromen-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propanamide Traditional Name: 3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propionamide Formula: C25H30N3O6S+ MolecularWeight: 500.5872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C25H29N3O6S/c1-17-21-9-6-19(33-3)16-23(21)34-25(30)22(17)10-11-24(29)26-18-4-7-20(8-5-18)35(31,32)28-14-12-27(2)13-15-28/h4-9,16H,10-15H2,1-3H3,(H,26,29)/p+1