1-cyano-3-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-(2-methoxyethyl)guanidine

Systemtic Name: 1-cyano-3-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-(2-methoxyethyl)guanidine Openeye Name: 1-cyano-3-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-(2-methoxyethyl)guanidine CAS Name: 1-cyano-3-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-(2-methoxyethyl)guanidine IUPAC Name: 1-cyano-3-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-2-(2-methoxyethyl)guanidine Traditional Name: 1-cyano-3-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-(2-methoxyethyl)guanidine Formula: C17H21N5O3 MolecularWeight: 343.38034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=NCCOC)NC#N)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C#N)NC(=NCCOC)NC#N)O)C

InChI

InChI=1S/C17H21N5O3/c1-17(2)15(23)14(22-16(21-10-19)20-6-7-24-3)12-8-11(9-18)4-5-13(12)25-17/h4-5,8,14-15,23H,6-7H2,1-3H3,(H2,20,21,22)/t14-,15+/m1/s1