(3R,4S)-4-(3-azanyl-6-bromanyl-indazol-1-yl)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3R,4S)-4-(3-azanyl-6-bromanyl-indazol-1-yl)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3R,4S)-4-(3-amino-6-bromo-indazol-1-yl)-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: (3R,4S)-4-(3-amino-6-bromo-1-indazolyl)-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3R,4S)-4-(3-amino-6-bromoindazol-1-yl)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3R,4S)-4-(3-amino-6-bromo-indazol-1-yl)-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C19H17BrN4O2 MolecularWeight: 413.26788

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C4=C(C=CC(=C4)Br)C(=N3)N)O)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=C(O1)C=CC(=C2)C#N)N3C4=C(C=CC(=C4)Br)C(=N3)N)O)C

InChI

InChI=1S/C19H17BrN4O2/c1-19(2)17(25)16(13-7-10(9-21)3-6-15(13)26-19)24-14-8-11(20)4-5-12(14)18(22)23-24/h3-8,16-17,25H,1-2H3,(H2,22,23)/t16-,17+/m0/s1