6-[2-[[(2-oxidanyl-3-phenoxy-propyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[2-[[(2-oxidanyl-3-phenoxy-propyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]naphthalene-2-carboxylic acid Openeye Name: 6-[2-[[(2-hydroxy-3-phenoxy-propyl)amino]methyl]chroman-6-yl]naphthalene-2-carboxylic acid CAS Name: 6-[2-[[(2-hydroxy-3-phenoxypropyl)amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[2-[[(2-hydroxy-3-phenoxypropyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]naphthalene-2-carboxylic acid Traditional Name: 6-[2-[[(2-hydroxy-3-phenoxy-propyl)amino]methyl]chroman-6-yl]-2-naphthoic acid Formula: C30H29NO5 MolecularWeight: 483.55496

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)OC1CNCC(COC5=CC=CC=C5)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)OC1CNCC(COC5=CC=CC=C5)O

InChI

InChI=1S/C30H29NO5/c32-26(19-35-27-4-2-1-3-5-27)17-31-18-28-12-10-24-15-23(11-13-29(24)36-28)20-6-7-22-16-25(30(33)34)9-8-21(22)14-20/h1-9,11,13-16,26,28,31-32H,10,12,17-19H2,(H,33,34)