methyl 7-[4-(3-ethoxypropoxy)phenyl]-1-methylsulfonyl-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: methyl 7-[4-(3-ethoxypropoxy)phenyl]-1-methylsulfonyl-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-[4-(3-ethoxypropoxy)phenyl]-1-methylsulfonyl-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-[4-(3-ethoxypropoxy)phenyl]-1-methylsulfonyl-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-[4-(3-ethoxypropoxy)phenyl]-1-methylsulfonyl-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-[4-(3-ethoxypropoxy)phenyl]-1-mesyl-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C24H29NO6S MolecularWeight: 459.55516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CCOCCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C24H29NO6S/c1-4-30-14-5-15-31-22-9-6-18(7-10-22)19-8-11-23-21(16-19)17-20(24(26)29-2)12-13-25(23)32(3,27)28/h6-11,16-17H,4-5,12-15H2,1-3H3