2-[3-[(E)-2-cyano-3-(cyclopentylamino)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoate

Systemtic Name: 2-[3-[(E)-2-cyano-3-(cyclopentylamino)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoate Openeye Name: 2-[3-[(E)-2-cyano-3-(cyclopentylamino)-3-oxo-prop-1-enyl]phenoxy]acetate CAS Name: 2-[3-[(E)-2-cyano-3-(cyclopentylamino)-3-oxoprop-1-enyl]phenoxy]acetate IUPAC Name: 2-[3-[(E)-2-cyano-3-(cyclopentylamino)-3-oxoprop-1-enyl]phenoxy]acetate Traditional Name: 2-[3-[(E)-2-cyano-3-(cyclopentylamino)-3-keto-prop-1-enyl]phenoxy]acetate Formula: C17H17N2O4- MolecularWeight: 313.32788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(=CC2=CC(=CC=C2)OCC(=O)[O-])C#N

Isomeric SMILES

C1CCC(C1)NC(=O)/C(=C/C2=CC(=CC=C2)OCC(=O)[O-])/C#N

InChI

InChI=1S/C17H18N2O4/c18-10-13(17(22)19-14-5-1-2-6-14)8-12-4-3-7-15(9-12)23-11-16(20)21/h3-4,7-9,14H,1-2,5-6,11H2,(H,19,22)(H,20,21)/p-1/b13-8+