methyl 2-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]pentanoate

Systemtic Name: methyl 2-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]pentanoate Openeye Name: methyl 2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]pentanoate CAS Name: 2-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]pentanoate Traditional Name: 2-[[(Z)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]valeric acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC)NC=C1C=CC=CC1=O

Isomeric SMILES

CCCC(C(=O)OC)N/C=C\1/C=CC=CC1=O

InChI

InChI=1S/C13H17NO3/c1-3-6-11(13(16)17-2)14-9-10-7-4-5-8-12(10)15/h4-5,7-9,11,14H,3,6H2,1-2H3/b10-9-