methyl 7-[4-(1-butoxyethoxy)phenyl]-1-thiophen-2-ylcarbonyl-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: methyl 7-[4-(1-butoxyethoxy)phenyl]-1-thiophen-2-ylcarbonyl-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-[4-(1-butoxyethoxy)phenyl]-1-(thiophene-2-carbonyl)-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-[4-(1-butoxyethoxy)phenyl]-1-[oxo(thiophen-2-yl)methyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-[4-(1-butoxyethoxy)phenyl]-1-(thiophene-2-carbonyl)-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-[4-(1-butoxyethoxy)phenyl]-1-(2-thenoyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C29H31NO5S MolecularWeight: 505.62514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)OC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)C(=O)C4=CC=CS4

Isomeric SMILES

CCCCOC(C)OC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)C(=O)C4=CC=CS4

InChI

InChI=1S/C29H31NO5S/c1-4-5-16-34-20(2)35-25-11-8-21(9-12-25)22-10-13-26-24(18-22)19-23(29(32)33-3)14-15-30(26)28(31)27-7-6-17-36-27/h6-13,17-20H,4-5,14-16H2,1-3H3