ethyl 3-azanyl-4-cyano-5,6,7,8,9,10-hexahydrobenzo[8]annulene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-cyano-5,6,7,8,9,10-hexahydrobenzo[8]annulene-2-carboxylate Openeye Name: ethyl 3-amino-4-cyano-5,6,7,8,9,10-hexahydrobenzo[8]annulene-2-carboxylate CAS Name: 3-amino-4-cyano-5,6,7,8,9,10-hexahydrobenzo[8]annulene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-cyano-5,6,7,8,9,10-hexahydrobenzo[8]annulene-2-carboxylate Traditional Name: 3-amino-4-cyano-5,6,7,8,9,10-hexahydrobenzocyclooctene-2-carboxylic acid ethyl ester Formula: C16H20N2O2 MolecularWeight: 272.3422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(CCCCCC2)C(=C1N)C#N

Isomeric SMILES

CCOC(=O)C1=CC2=C(CCCCCC2)C(=C1N)C#N

InChI

InChI=1S/C16H20N2O2/c1-2-20-16(19)13-9-11-7-5-3-4-6-8-12(11)14(10-17)15(13)18/h9H,2-8,18H2,1H3