(1E)-2-cyano-4-[4-(3-methoxythiophen-2-yl)oxyphenoxy]-3-oxidanylidene-1-pyrrol-2-ylidene-pentan-1-olate

Systemtic Name: (1E)-2-cyano-4-[4-(3-methoxythiophen-2-yl)oxyphenoxy]-3-oxidanylidene-1-pyrrol-2-ylidene-pentan-1-olate Openeye Name: (1E)-2-cyano-4-[4-[(3-methoxy-2-thienyl)oxy]phenoxy]-3-oxo-1-pyrrol-2-ylidene-pentan-1-olate CAS Name: (1E)-2-cyano-4-[4-[(3-methoxy-2-thiophenyl)oxy]phenoxy]-3-oxo-1-(2-pyrrolylidene)-1-pentanolate IUPAC Name: (1E)-2-cyano-4-[4-(3-methoxythiophen-2-yl)oxyphenoxy]-3-oxo-1-pyrrol-2-ylidenepentan-1-olate Traditional Name: (1E)-2-cyano-3-keto-4-[4-[(3-methoxy-2-thienyl)oxy]phenoxy]-1-pyrrol-2-ylidene-pentan-1-olate Formula: C21H17N2O5S- MolecularWeight: 409.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C#N)C(=C1C=CC=N1)[O-])OC2=CC=C(C=C2)OC3=C(C=CS3)OC

Isomeric SMILES

CC(C(=O)C(C#N)/C(=C\1/C=CC=N1)/[O-])OC2=CC=C(C=C2)OC3=C(C=CS3)OC

InChI

InChI=1S/C21H18N2O5S/c1-13(19(24)16(12-22)20(25)17-4-3-10-23-17)27-14-5-7-15(8-6-14)28-21-18(26-2)9-11-29-21/h3-11,13,16,25H,1-2H3/p-1/b20-17+