ethyl (2E)-2-(azepan-2-ylidene)-4-methyl-3-oxidanylidene-pentanoate

Systemtic Name: ethyl (2E)-2-(azepan-2-ylidene)-4-methyl-3-oxidanylidene-pentanoate Openeye Name: ethyl (2E)-2-(azepan-2-ylidene)-4-methyl-3-oxo-pentanoate CAS Name: (2E)-2-(2-azepanylidene)-4-methyl-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-(azepan-2-ylidene)-4-methyl-3-oxopentanoate Traditional Name: (2E)-2-(azepan-2-ylidene)-3-keto-4-methyl-valeric acid ethyl ester Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1CCCCCN1)C(=O)C(C)C

Isomeric SMILES

CCOC(=O)/C(=C/1\CCCCCN1)/C(=O)C(C)C

InChI

InChI=1S/C14H23NO3/c1-4-18-14(17)12(13(16)10(2)3)11-8-6-5-7-9-15-11/h10,15H,4-9H2,1-3H3/b12-11+