methyl 7-bromanyl-1-(thiophen-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: methyl 7-bromanyl-1-(thiophen-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-bromo-1-(2-thienylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-bromo-1-(thiophen-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-bromo-1-(thiophen-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-bromo-1-(2-thenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C17H16BrNO2S MolecularWeight: 378.28344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=CC(=C2)Br)N(CC1)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC2=C(C=CC(=C2)Br)N(CC1)CC3=CC=CS3

InChI

InChI=1S/C17H16BrNO2S/c1-21-17(20)12-6-7-19(11-15-3-2-8-22-15)16-5-4-14(18)10-13(16)9-12/h2-5,8-10H,6-7,11H2,1H3