1-cyano-3-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-ethyl-guanidine

Systemtic Name: 1-cyano-3-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-ethyl-guanidine Openeye Name: 1-cyano-3-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-2-ethyl-guanidine CAS Name: 1-cyano-3-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-2-ethylguanidine IUPAC Name: 1-cyano-3-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-2-ethylguanidine Traditional Name: 1-cyano-3-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-2-ethyl-guanidine Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC#N)NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

Isomeric SMILES

CCN=C(NC#N)NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

InChI

InChI=1S/C16H19N5O2/c1-4-19-15(20-9-18)21-13-11-7-10(8-17)5-6-12(11)23-16(2,3)14(13)22/h5-7,13-14,22H,4H2,1-3H3,(H2,19,20,21)