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

Systemtic Name: methyl 6-[2-[[(2-oxidanyl-3-phenoxy-propyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]naphthalene-2-carboxylate Openeye Name: methyl 6-[2-[[(2-hydroxy-3-phenoxy-propyl)amino]methyl]chroman-6-yl]naphthalene-2-carboxylate CAS Name: 6-[2-[[(2-hydroxy-3-phenoxypropyl)amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-[[(2-hydroxy-3-phenoxypropyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]naphthalene-2-carboxylate Traditional Name: 6-[2-[[(2-hydroxy-3-phenoxy-propyl)amino]methyl]chroman-6-yl]naphthalene-2-carboxylic acid methyl ester Formula: C31H31NO5 MolecularWeight: 497.58154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C3=CC4=C(C=C3)OC(CC4)CNCC(COC5=CC=CC=C5)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C3=CC4=C(C=C3)OC(CC4)CNCC(COC5=CC=CC=C5)O

InChI

InChI=1S/C31H31NO5/c1-35-31(34)26-10-9-22-15-21(7-8-23(22)17-26)24-12-14-30-25(16-24)11-13-29(37-30)19-32-18-27(33)20-36-28-5-3-2-4-6-28/h2-10,12,14-17,27,29,32-33H,11,13,18-20H2,1H3