(3S)-7-azanyl-2,2-dimethyl-3-oxidanyl-5-pyrrolidin-1-yl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3S)-7-azanyl-2,2-dimethyl-3-oxidanyl-5-pyrrolidin-1-yl-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3S)-7-amino-3-hydroxy-2,2-dimethyl-5-pyrrolidin-1-yl-chromane-6-carbonitrile CAS Name: (3S)-7-amino-3-hydroxy-2,2-dimethyl-5-(1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3S)-7-amino-3-hydroxy-2,2-dimethyl-5-pyrrolidin-1-yl-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3S)-7-amino-3-hydroxy-2,2-dimethyl-5-pyrrolidino-chroman-6-carbonitrile Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=C(C(=C2N3CCCC3)C#N)N)O)C

Isomeric SMILES

CC1([C@H](CC2=C(O1)C=C(C(=C2N3CCCC3)C#N)N)O)C

InChI

InChI=1S/C16H21N3O2/c1-16(2)14(20)7-10-13(21-16)8-12(18)11(9-17)15(10)19-5-3-4-6-19/h8,14,20H,3-7,18H2,1-2H3/t14-/m0/s1