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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CNCCC2=CC=C(C=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)O

Isomeric SMILES

C1=CC(=CN=C1)[C@H](CNCCC2=CC=C(C=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)O

InChI

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