N-[4-(4-octanoylpiperazin-1-yl)phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-(4-octanoylpiperazin-1-yl)phenyl]naphthalene-2-sulfonamide Openeye Name: N-[4-(4-octanoylpiperazin-1-yl)phenyl]naphthalene-2-sulfonamide CAS Name: N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-(4-octanoylpiperazin-1-yl)phenyl]naphthalene-2-sulfonamide Traditional Name: N-[4-(4-caprylylpiperazino)phenyl]naphthalene-2-sulfonamide Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H35N3O3S/c1-2-3-4-5-6-11-28(32)31-20-18-30(19-21-31)26-15-13-25(14-16-26)29-35(33,34)27-17-12-23-9-7-8-10-24(23)22-27/h7-10,12-17,22,29H,2-6,11,18-21H2,1H3