(Z)-but-2-enedioic acid; N-[2-(2,4-dimethylpyrrolidin-1-yl)ethyl]naphthalene-1-sulfonamide

Systemtic Name: (Z)-but-2-enedioic acid; N-[2-(2,4-dimethylpyrrolidin-1-yl)ethyl]naphthalene-1-sulfonamide Openeye Name: N-[2-(2,4-dimethylpyrrolidin-1-yl)ethyl]naphthalene-1-sulfonamide; maleic acid CAS Name: (Z)-2-butenedioic acid; N-[2-(2,4-dimethyl-1-pyrrolidinyl)ethyl]-1-naphthalenesulfonamide IUPAC Name: (Z)-but-2-enedioic acid; N-[2-(2,4-dimethylpyrrolidin-1-yl)ethyl]naphthalene-1-sulfonamide Traditional Name: N-[2-(2,4-dimethylpyrrolidino)ethyl]naphthalene-1-sulfonamide; maleic acid Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1)CCNS(=O)(=O)C2=CC=CC3=CC=CC=C32)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1CC(N(C1)CCNS(=O)(=O)C2=CC=CC3=CC=CC=C32)C.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C18H24N2O2S.C4H4O4/c1-14-12-15(2)20(13-14)11-10-19-23(21,22)18-9-5-7-16-6-3-4-8-17(16)18;5-3(6)1-2-4(7)8/h3-9,14-15,19H,10-13H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-