[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate CAS Name: 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate Traditional Name: 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OCC(=O)OCC(=O)C(=C(C)N)C#N)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O5/c1-4-5-13-6-7-16(17(8-13)23-3)24-11-18(22)25-10-15(21)14(9-19)12(2)20/h4-8H,10-11,20H2,1-3H3/b5-4+,14-12+