ethyl 1-(4-methylphenyl)sulfonyl-7-(4-morpholin-4-ylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)sulfonyl-7-(4-morpholin-4-ylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: ethyl 7-(4-morpholinophenyl)-1-(p-tolylsulfonyl)-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-7-[4-(4-morpholinyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)sulfonyl-7-(4-morpholin-4-ylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-(4-morpholinophenyl)-1-tosyl-2,3-dihydro-1-benzazepine-4-carboxylic acid ethyl ester Formula: C30H32N2O5S MolecularWeight: 532.65048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=CC(=C2)C3=CC=C(C=C3)N4CCOCC4)N(CC1)S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=CC(=C2)C3=CC=C(C=C3)N4CCOCC4)N(CC1)S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C30H32N2O5S/c1-3-37-30(33)25-14-15-32(38(34,35)28-11-4-22(2)5-12-28)29-13-8-24(20-26(29)21-25)23-6-9-27(10-7-23)31-16-18-36-19-17-31/h4-13,20-21H,3,14-19H2,1-2H3