[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidenechromen-7-yl)oxyethanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidenechromen-7-yl)oxyethanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 2-(2-oxochromen-7-yl)oxyacetate CAS Name: 2-[(2-oxo-1-benzopyran-7-yl)oxy]acetic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(2-oxochromen-7-yl)oxyacetate Traditional Name: 2-(2-ketochromen-7-yl)oxyacetic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C19H18N2O6/c20-12-19(7-1-2-8-19)21-16(22)10-26-18(24)11-25-14-5-3-13-4-6-17(23)27-15(13)9-14/h3-6,9H,1-2,7-8,10-11H2,(H,21,22)