(3R,4S)-4-(furan-2-ylmethylamino)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3R,4S)-4-(furan-2-ylmethylamino)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3R,4S)-4-(2-furylmethylamino)-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: (3R,4S)-4-(2-furanylmethylamino)-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3R,4S)-4-(furan-2-ylmethylamino)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3R,4S)-4-(2-furfurylamino)-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NCC3=CC=CO3)O)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=C(O1)C=CC(=C2)C#N)NCC3=CC=CO3)O)C

InChI

InChI=1S/C17H18N2O3/c1-17(2)16(20)15(19-10-12-4-3-7-21-12)13-8-11(9-18)5-6-14(13)22-17/h3-8,15-16,19-20H,10H2,1-2H3/t15-,16+/m0/s1