1-[3-(1-aminocarbonylpiperidin-4-yl)-4-methoxy-phenyl]naphthalene-2-sulfonic acid

Systemtic Name: 1-[3-(1-aminocarbonylpiperidin-4-yl)-4-methoxy-phenyl]naphthalene-2-sulfonic acid Openeye Name: 1-[3-(1-carbamoyl-4-piperidyl)-4-methoxy-phenyl]naphthalene-2-sulfonic acid CAS Name: 1-[3-(1-carbamoyl-4-piperidinyl)-4-methoxyphenyl]-2-naphthalenesulfonic acid IUPAC Name: 1-[3-(1-carbamoylpiperidin-4-yl)-4-methoxyphenyl]naphthalene-2-sulfonic acid Traditional Name: 1-[3-(1-carbamoyl-4-piperidyl)-4-methoxy-phenyl]naphthalene-2-sulfonic acid Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=CC3=CC=CC=C32)S(=O)(=O)O)C4CCN(CC4)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=CC3=CC=CC=C32)S(=O)(=O)O)C4CCN(CC4)C(=O)N

InChI

InChI=1S/C23H24N2O5S/c1-30-20-8-6-17(14-19(20)16-10-12-25(13-11-16)23(24)26)22-18-5-3-2-4-15(18)7-9-21(22)31(27,28)29/h2-9,14,16H,10-13H2,1H3,(H2,24,26)(H,27,28,29)