methyl 3-(2-hydroxyethyl)-7,8-bis(oxidanyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-9-carboxylate

Systemtic Name: methyl 3-(2-hydroxyethyl)-7,8-bis(oxidanyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-9-carboxylate Openeye Name: methyl 7,8-dihydroxy-3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-9-carboxylate CAS Name: 7,8-dihydroxy-3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-9-carboxylic acid methyl ester IUPAC Name: methyl 7,8-dihydroxy-3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-9-carboxylate Traditional Name: 7,8-dihydroxy-3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-9-carboxylic acid methyl ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCN(CC(C2=CC(=C1O)O)C3=CC=CC=C3)CCO

Isomeric SMILES

COC(=O)C1=C2CCN(CC(C2=CC(=C1O)O)C3=CC=CC=C3)CCO

InChI

InChI=1S/C20H23NO5/c1-26-20(25)18-14-7-8-21(9-10-22)12-16(13-5-3-2-4-6-13)15(14)11-17(23)19(18)24/h2-6,11,16,22-24H,7-10,12H2,1H3