N'-(6-bromanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-N-cyano-pyridine-3-carboximidamide

Systemtic Name: N'-(6-bromanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-N-cyano-pyridine-3-carboximidamide Openeye Name: N'-(6-bromo-3-hydroxy-2,2-dimethyl-chroman-4-yl)-N-cyano-pyridine-3-carboxamidine CAS Name: N'-(6-bromo-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-N-cyano-3-pyridinecarboximidamide IUPAC Name: N'-(6-bromo-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-N-cyanopyridine-3-carboximidamide Traditional Name: N'-(6-bromo-3-hydroxy-2,2-dimethyl-chroman-4-yl)-N-cyano-nicotinamidine Formula: C18H17BrN4O2 MolecularWeight: 401.25718

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)Br)N=C(C3=CN=CC=C3)NC#N)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)Br)N=C(C3=CN=CC=C3)NC#N)O)C

InChI

InChI=1S/C18H17BrN4O2/c1-18(2)16(24)15(13-8-12(19)5-6-14(13)25-18)23-17(22-10-20)11-4-3-7-21-9-11/h3-9,15-16,24H,1-2H3,(H,22,23)