6-[4-[2-[[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]amino]ethyl]phenyl]naphthalene-1-carboxylic acid

Systemtic Name: 6-[4-[2-[[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]amino]ethyl]phenyl]naphthalene-1-carboxylic acid Openeye Name: 6-[4-[2-[[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]naphthalene-1-carboxylic acid CAS Name: 6-[4-[2-[[(2R)-2-hydroxy-2-(3-pyridinyl)ethyl]amino]ethyl]phenyl]-1-naphthalenecarboxylic acid IUPAC Name: 6-[4-[2-[[(2R)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]naphthalene-1-carboxylic acid Traditional Name: 6-[4-[2-[[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-1-naphthoic acid Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C3=CC=C(C=C3)CCNCC(C4=CN=CC=C4)O)C(=C1)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C3=CC=C(C=C3)CCNC[C@@H](C4=CN=CC=C4)O)C(=C1)C(=O)O

InChI

InChI=1S/C26H24N2O3/c29-25(22-4-2-13-27-16-22)17-28-14-12-18-6-8-19(9-7-18)20-10-11-23-21(15-20)3-1-5-24(23)26(30)31/h1-11,13,15-16,25,28-29H,12,14,17H2,(H,30,31)/t25-/m0/s1