ethyl 1-cyano-2-(methoxycarbonylamino)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-3-carboxylate

Systemtic Name: ethyl 1-cyano-2-(methoxycarbonylamino)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-3-carboxylate Openeye Name: ethyl 1-cyano-2-(methoxycarbonylamino)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-3-carboxylate CAS Name: 1-cyano-2-(methoxycarbonylamino)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-cyano-2-(methoxycarbonylamino)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-3-carboxylate Traditional Name: 2-(carbomethoxyamino)-1-cyano-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-3-carboxylic acid ethyl ester Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1CCCCC2)C#N)NC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1CCCCC2)C#N)NC(=O)OC

InChI

InChI=1S/C15H19N3O4/c1-3-22-14(19)13-12(17-15(20)21-2)10(9-16)11-7-5-4-6-8-18(11)13/h3-8H2,1-2H3,(H,17,20)