phenyl N-cyano-N'-(6-cyano-2,2-dimethyl-3,4-dihydrochromen-4-yl)carbamimidate

Systemtic Name: phenyl N-cyano-N'-(6-cyano-2,2-dimethyl-3,4-dihydrochromen-4-yl)carbamimidate Openeye Name: 1-cyano-3-(6-cyano-2,2-dimethyl-chroman-4-yl)-2-phenyl-isourea CAS Name: N-cyano-N'-(6-cyano-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)carbamimidic acid phenyl ester IUPAC Name: phenyl N-cyano-N'-(6-cyano-2,2-dimethyl-3,4-dihydrochromen-4-yl)carbamimidate Traditional Name: 1-cyano-3-(6-cyano-2,2-dimethyl-chroman-4-yl)-2-phenyl-isourea Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC(=C2)C#N)N=C(NC#N)OC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC(=C2)C#N)N=C(NC#N)OC3=CC=CC=C3)C

InChI

InChI=1S/C20H18N4O2/c1-20(2)11-17(16-10-14(12-21)8-9-18(16)26-20)24-19(23-13-22)25-15-6-4-3-5-7-15/h3-10,17H,11H2,1-2H3,(H,23,24)