methyl 1-[(2-azidophenyl)methyl]-3-(2-cyanoethyl)-3-ethyl-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: methyl 1-[(2-azidophenyl)methyl]-3-(2-cyanoethyl)-3-ethyl-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: methyl 1-[(2-azidophenyl)methyl]-3-(2-cyanoethyl)-3-ethyl-2-oxo-cyclopentanecarboxylate CAS Name: 1-[(2-azidophenyl)methyl]-3-(2-cyanoethyl)-3-ethyl-2-oxo-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-azidophenyl)methyl]-3-(2-cyanoethyl)-3-ethyl-2-oxocyclopentane-1-carboxylate Traditional Name: 1-(2-azidobenzyl)-3-(2-cyanoethyl)-3-ethyl-2-keto-cyclopentanecarboxylic acid methyl ester Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(C1=O)(CC2=CC=CC=C2N=[N+]=[N-])C(=O)OC)CCC#N

Isomeric SMILES

CCC1(CCC(C1=O)(CC2=CC=CC=C2N=[N+]=[N-])C(=O)OC)CCC#N

InChI

InChI=1S/C19H22N4O3/c1-3-18(9-6-12-20)10-11-19(16(18)24,17(25)26-2)13-14-7-4-5-8-15(14)22-23-21/h4-5,7-8H,3,6,9-11,13H2,1-2H3