[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 3-methoxy-4-(3-methylbutoxy)benzoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 3-methoxy-4-(3-methylbutoxy)benzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 4-isopentyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(3-methylbutoxy)benzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 3-methoxy-4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxy-3-methoxy-benzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C19H24N2O5 MolecularWeight: 360.40426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)OCC(=O)C(=C(C)N)C#N)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)OCC(=O)/C(=C(\C)/N)/C#N)OC

InChI

InChI=1S/C19H24N2O5/c1-12(2)7-8-25-17-6-5-14(9-18(17)24-4)19(23)26-11-16(22)15(10-20)13(3)21/h5-6,9,12H,7-8,11,21H2,1-4H3/b15-13+