[6-cyano-4-[[(cyanoamino)-pyridin-3-yl-methylidene]amino]-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate

Systemtic Name: [6-cyano-4-[[(cyanoamino)-pyridin-3-yl-methylidene]amino]-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-4-[[(cyanoamino)-(3-pyridyl)methylene]amino]-2,2-dimethyl-chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-4-[[(cyanoamino)-(3-pyridinyl)methylidene]amino]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-4-[[(cyanoamino)-pyridin-3-ylmethylidene]amino]-2,2-dimethyl-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-[[(cyanoamino)-(3-pyridyl)methylene]amino]-2,2-dimethyl-chroman-3-yl] ester Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N=C(C3=CN=CC=C3)NC#N

Isomeric SMILES

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N=C(C3=CN=CC=C3)NC#N

InChI

InChI=1S/C21H19N5O3/c1-13(27)28-19-18(26-20(25-12-23)15-5-4-8-24-11-15)16-9-14(10-22)6-7-17(16)29-21(19,2)3/h4-9,11,18-19H,1-3H3,(H,25,26)