(phenylmethyl) 7-oxidanyl-8-phenylmethoxy-5-(4-phenylmethoxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

Systemtic Name: (phenylmethyl) 7-oxidanyl-8-phenylmethoxy-5-(4-phenylmethoxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Openeye Name: benzyl 8-benzyloxy-5-(4-benzyloxyphenyl)-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate CAS Name: 7-hydroxy-8-phenylmethoxy-5-(4-phenylmethoxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-hydroxy-8-phenylmethoxy-5-(4-phenylmethoxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Traditional Name: 8-benzoxy-5-(4-benzoxyphenyl)-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid benzyl ester Formula: C38H35NO5 MolecularWeight: 585.6882

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C2=CC(=C(C=C21)OCC3=CC=CC=C3)O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CN(CC(C2=CC(=C(C=C21)OCC3=CC=CC=C3)O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C38H35NO5/c40-36-23-34-32(22-37(36)43-26-29-12-6-2-7-13-29)20-21-39(38(41)44-27-30-14-8-3-9-15-30)24-35(34)31-16-18-33(19-17-31)42-25-28-10-4-1-5-11-28/h1-19,22-23,35,40H,20-21,24-27H2