2-(6-bromanyl-2,2-dimethyl-3,4-dihydrochromen-4-yl)-1-cyano-3-(3-cyanophenyl)guanidine

Systemtic Name: 2-(6-bromanyl-2,2-dimethyl-3,4-dihydrochromen-4-yl)-1-cyano-3-(3-cyanophenyl)guanidine Openeye Name: 2-(6-bromo-2,2-dimethyl-chroman-4-yl)-1-cyano-3-(3-cyanophenyl)guanidine CAS Name: 2-(6-bromo-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-1-cyano-3-(3-cyanophenyl)guanidine IUPAC Name: 2-(6-bromo-2,2-dimethyl-3,4-dihydrochromen-4-yl)-1-cyano-3-(3-cyanophenyl)guanidine Traditional Name: 2-(6-bromo-2,2-dimethyl-chroman-4-yl)-1-cyano-3-(3-cyanophenyl)guanidine Formula: C20H18BrN5O MolecularWeight: 424.29382

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC(=C2)Br)N=C(NC#N)NC3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC(=C2)Br)N=C(NC#N)NC3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C20H18BrN5O/c1-20(2)10-17(16-9-14(21)6-7-18(16)27-20)26-19(24-12-23)25-15-5-3-4-13(8-15)11-22/h3-9,17H,10H2,1-2H3,(H2,24,25,26)