ethyl (4Z,6Z,8Z,10Z,12Z)-2-azanylcyclododeca[b]thiophene-3-carboxylate

Systemtic Name: ethyl (4Z,6Z,8Z,10Z,12Z)-2-azanylcyclododeca[b]thiophene-3-carboxylate Openeye Name: ethyl (4Z,6Z,8Z,10Z,12Z)-2-aminocyclododeca[b]thiophene-3-carboxylate CAS Name: (4Z,6Z,8Z,10Z,12Z)-2-amino-3-cyclododeca[b]thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z,6Z,8Z,10Z,12Z)-2-aminocyclododeca[b]thiophene-3-carboxylate Traditional Name: (4Z,6Z,8Z,10Z,12Z)-2-aminocyclododeca[b]thiophene-3-carboxylic acid ethyl ester Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1C=CC=CC=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C1=C(SC/2=C1/C=C\C=C/C=C\C=C/C=C2)N

InChI

InChI=1S/C17H17NO2S/c1-2-20-17(19)15-13-11-9-7-5-3-4-6-8-10-12-14(13)21-16(15)18/h3-12H,2,18H2,1H3/b4-3-,5-3?,6-4?,7-5-,8-6-,9-7?,10-8?,11-9-,12-10-,13-11?,14-12?