methyl 1-(hydroxymethyl)-7-phenylmethoxy-1,2,3,4-tetrahydrobenzo[g][1]benzazepine-5-carboxylate

Systemtic Name: methyl 1-(hydroxymethyl)-7-phenylmethoxy-1,2,3,4-tetrahydrobenzo[g][1]benzazepine-5-carboxylate Openeye Name: methyl 7-benzyloxy-1-(hydroxymethyl)-1,2,3,4-tetrahydrobenzo[g][1]benzazepine-5-carboxylate CAS Name: 1-(hydroxymethyl)-7-phenylmethoxy-1,2,3,4-tetrahydrobenzo[g][1]benzazepine-5-carboxylic acid methyl ester IUPAC Name: methyl 1-(hydroxymethyl)-7-phenylmethoxy-1,2,3,4-tetrahydrobenzo[g][1]benzazepine-5-carboxylate Traditional Name: 7-benzoxy-1-methylol-1,2,3,4-tetrahydrobenzo[g][1]benzazepine-5-carboxylic acid methyl ester Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC(C2=C1C=C(C3=CC=CC=C32)OCC4=CC=CC=C4)CO

Isomeric SMILES

COC(=O)N1CCCC(C2=C1C=C(C3=CC=CC=C32)OCC4=CC=CC=C4)CO

InChI

InChI=1S/C24H25NO4/c1-28-24(27)25-13-7-10-18(15-26)23-20-12-6-5-11-19(20)22(14-21(23)25)29-16-17-8-3-2-4-9-17/h2-6,8-9,11-12,14,18,26H,7,10,13,15-16H2,1H3