4-[2-[[[2-oxidanyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl]amino]methyl]-3,4-dihydro-2H-chromen-6-yl]benzoic acid

Systemtic Name: 4-[2-[[[2-oxidanyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl]amino]methyl]-3,4-dihydro-2H-chromen-6-yl]benzoic acid Openeye Name: 4-[2-[[(2-hydroxy-3-tetralin-6-yloxy-propyl)amino]methyl]chroman-6-yl]benzoic acid CAS Name: 4-[2-[[[2-hydroxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl]amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]benzoic acid IUPAC Name: 4-[2-[[[2-hydroxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl]amino]methyl]-3,4-dihydro-2H-chromen-6-yl]benzoic acid Traditional Name: 4-[2-[[(2-hydroxy-3-tetralin-6-yloxy-propyl)amino]methyl]chroman-6-yl]benzoic acid Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)OCC(CNCC3CCC4=C(O3)C=CC(=C4)C5=CC=C(C=C5)C(=O)O)O

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)OCC(CNCC3CCC4=C(O3)C=CC(=C4)C5=CC=C(C=C5)C(=O)O)O

InChI

InChI=1S/C30H33NO5/c32-26(19-35-27-12-9-20-3-1-2-4-23(20)16-27)17-31-18-28-13-10-25-15-24(11-14-29(25)36-28)21-5-7-22(8-6-21)30(33)34/h5-9,11-12,14-16,26,28,31-32H,1-4,10,13,17-19H2,(H,33,34)