N-[4-[4-(3-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-[4-(3-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]naphthalene-2-sulfonamide Openeye Name: N-[4-[4-(3-methoxyphenyl)piperazin-1-yl]-4-oxo-butyl]naphthalene-2-sulfonamide CAS Name: N-[4-[4-(3-methoxyphenyl)-1-piperazinyl]-4-oxobutyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-[4-(3-methoxyphenyl)piperazin-1-yl]-4-oxobutyl]naphthalene-2-sulfonamide Traditional Name: N-[4-keto-4-[4-(3-methoxyphenyl)piperazino]butyl]naphthalene-2-sulfonamide Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CCCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CCCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H29N3O4S/c1-32-23-9-4-8-22(19-23)27-14-16-28(17-15-27)25(29)10-5-13-26-33(30,31)24-12-11-20-6-2-3-7-21(20)18-24/h2-4,6-9,11-12,18-19,26H,5,10,13-17H2,1H3