methyl 4-[[4-[(E)-2-cyano-3-oxidanylidene-3-(1-phenylethylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(E)-2-cyano-3-oxidanylidene-3-(1-phenylethylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(E)-2-cyano-3-oxo-3-(1-phenylethylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-2-cyano-3-oxo-3-(1-phenylethylamino)prop-1-enyl]-2-methoxyphenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-2-cyano-3-oxo-3-(1-phenylethylamino)prop-1-enyl]-2-methoxyphenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-2-cyano-3-keto-3-(1-phenylethylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoic acid methyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)OC)C#N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)OC)/C#N

InChI

InChI=1S/C28H26N2O5/c1-19(22-7-5-4-6-8-22)30-27(31)24(17-29)15-21-11-14-25(26(16-21)33-2)35-18-20-9-12-23(13-10-20)28(32)34-3/h4-16,19H,18H2,1-3H3,(H,30,31)/b24-15+