2,2-bis(methoxymethyl)-3-oxidanyl-4-(pyridin-3-ylamino)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-bis(methoxymethyl)-3-oxidanyl-4-(pyridin-3-ylamino)-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-(3-pyridylamino)chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-(3-pyridinylamino)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-(pyridin-3-ylamino)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-(3-pyridylamino)chroman-6-carbonitrile Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CN=CC=C3)O)COC

Isomeric SMILES

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CN=CC=C3)O)COC

InChI

InChI=1S/C19H21N3O4/c1-24-11-19(12-25-2)18(23)17(22-14-4-3-7-21-10-14)15-8-13(9-20)5-6-16(15)26-19/h3-8,10,17-18,22-23H,11-12H2,1-2H3