4-[1,3-benzoxazol-2-yl(2-morpholin-4-ylethyl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[1,3-benzoxazol-2-yl(2-morpholin-4-ylethyl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[1,3-benzoxazol-2-yl(2-morpholinoethyl)amino]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-[1,3-benzoxazol-2-yl-[2-(4-morpholinyl)ethyl]amino]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[1,3-benzoxazol-2-yl(2-morpholin-4-ylethyl)amino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[1,3-benzoxazol-2-yl(2-morpholinoethyl)amino]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CCN3CCOCC3)C4=NC5=CC=CC=C5O4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CCN3CCOCC3)C4=NC5=CC=CC=C5O4)O)C

InChI

InChI=1S/C25H28N4O4/c1-25(2)23(30)22(18-15-17(16-26)7-8-20(18)33-25)29(10-9-28-11-13-31-14-12-28)24-27-19-5-3-4-6-21(19)32-24/h3-8,15,22-23,30H,9-14H2,1-2H3