7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-9-carboxylic acid

Systemtic Name: 7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-9-carboxylic acid Openeye Name: 7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-9-carboxylic acid CAS Name: 7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-9-carboxylic acid IUPAC Name: 7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-9-carboxylic acid Traditional Name: 7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-9-carboxylic acid Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CNCCC3=C(C(=C(C=C23)OC)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2CNCCC3=C(C(=C(C=C23)OC)OC)C(=O)O

InChI

InChI=1S/C20H23NO5/c1-24-13-6-4-12(5-7-13)16-11-21-9-8-14-15(16)10-17(25-2)19(26-3)18(14)20(22)23/h4-7,10,16,21H,8-9,11H2,1-3H3,(H,22,23)