1-cyano-2-[(3S,4R)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3-phenyl-guanidine

Systemtic Name: 1-cyano-2-[(3S,4R)-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3-phenyl-guanidine Openeye Name: 1-cyano-2-[(3S,4R)-3-hydroxy-2,2-dimethyl-chroman-4-yl]-3-phenyl-guanidine CAS Name: 1-cyano-2-[(3S,4R)-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-3-phenylguanidine IUPAC Name: 1-cyano-2-[(3S,4R)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-phenylguanidine Traditional Name: 1-cyano-2-[(3S,4R)-3-hydroxy-2,2-dimethyl-chroman-4-yl]-3-phenyl-guanidine Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=CC=CC=C2O1)N=C(NC#N)NC3=CC=CC=C3)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=CC=CC=C2O1)N=C(NC#N)NC3=CC=CC=C3)O)C

InChI

InChI=1S/C19H20N4O2/c1-19(2)17(24)16(14-10-6-7-11-15(14)25-19)23-18(21-12-20)22-13-8-4-3-5-9-13/h3-11,16-17,24H,1-2H3,(H2,21,22,23)/t16-,17+/m1/s1