ethyl 2-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-bromo-2-hydroxy-phenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[(5-bromo-2-hydroxyphenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromo-2-hydroxyphenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(5-bromo-2-hydroxy-benzyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C17H18BrNO3S MolecularWeight: 396.29872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NCC3=C(C=CC(=C3)Br)O

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NCC3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C17H18BrNO3S/c1-2-22-17(21)15-12-4-3-5-14(12)23-16(15)19-9-10-8-11(18)6-7-13(10)20/h6-8,19-20H,2-5,9H2,1H3