4-(2,3-dihydro-1H-inden-5-yl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-yl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-4-oxidanylidene-butanamide Openeye Name: 4-indan-5-yl-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-4-oxo-butanamide CAS Name: 4-(2,3-dihydro-1H-inden-5-yl)-N-[2-methoxy-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-4-oxobutanamide IUPAC Name: 4-(2,3-dihydro-1H-inden-5-yl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-oxobutanamide Traditional Name: 4-indan-5-yl-4-keto-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]butyramide Formula: C25H32N3O5S+ MolecularWeight: 486.60368

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)CCC(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)CCC(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C25H31N3O5S/c1-27-12-14-28(15-13-27)34(31,32)21-8-10-24(33-2)22(17-21)26-25(30)11-9-23(29)20-7-6-18-4-3-5-19(18)16-20/h6-8,10,16-17H,3-5,9,11-15H2,1-2H3,(H,26,30)/p+1