ethyl (5Z,7E)-5-ethyl-4-methoxy-1-(phenylmethyl)-3,4-dihydro-2H-azocine-7-carboxylate

Systemtic Name: ethyl (5Z,7E)-5-ethyl-4-methoxy-1-(phenylmethyl)-3,4-dihydro-2H-azocine-7-carboxylate Openeye Name: ethyl (5Z,7E)-1-benzyl-5-ethyl-4-methoxy-3,4-dihydro-2H-azocine-7-carboxylate CAS Name: (5Z,7E)-5-ethyl-4-methoxy-1-(phenylmethyl)-3,4-dihydro-2H-azocine-7-carboxylic acid ethyl ester IUPAC Name: ethyl (5Z,7E)-1-benzyl-5-ethyl-4-methoxy-3,4-dihydro-2H-azocine-7-carboxylate Traditional Name: (5Z,7E)-1-benzyl-5-ethyl-4-methoxy-3,4-dihydro-2H-azocine-7-carboxylic acid ethyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CN(CCC1OC)CC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CC/C/1=C/C(=C\N(CCC1OC)CC2=CC=CC=C2)/C(=O)OCC

InChI

InChI=1S/C20H27NO3/c1-4-17-13-18(20(22)24-5-2)15-21(12-11-19(17)23-3)14-16-9-7-6-8-10-16/h6-10,13,15,19H,4-5,11-12,14H2,1-3H3/b17-13-,18-15+