[4-[(E)-2-cyano-3-oxidanylidene-3-(propylamino)prop-1-enyl]-2-methoxy-phenyl] butanoate

Systemtic Name: [4-[(E)-2-cyano-3-oxidanylidene-3-(propylamino)prop-1-enyl]-2-methoxy-phenyl] butanoate Openeye Name: [4-[(E)-2-cyano-3-oxo-3-(propylamino)prop-1-enyl]-2-methoxy-phenyl] butanoate CAS Name: butanoic acid [4-[(E)-2-cyano-3-oxo-3-(propylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-oxo-3-(propylamino)prop-1-enyl]-2-methoxyphenyl] butanoate Traditional Name: butyric acid [4-[(E)-2-cyano-3-keto-3-(propylamino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NCCC)OC

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCCC)OC

InChI

InChI=1S/C18H22N2O4/c1-4-6-17(21)24-15-8-7-13(11-16(15)23-3)10-14(12-19)18(22)20-9-5-2/h7-8,10-11H,4-6,9H2,1-3H3,(H,20,22)/b14-10+