1-[6-azanyl-2-(diethoxymethyl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1-cyano-2-(phenylmethyl)guanidine

Systemtic Name: 1-[6-azanyl-2-(diethoxymethyl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1-cyano-2-(phenylmethyl)guanidine Openeye Name: 1-[6-amino-2-(diethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]-2-benzyl-1-cyano-guanidine CAS Name: 1-[6-amino-2-(diethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1-cyano-2-(phenylmethyl)guanidine IUPAC Name: 1-[6-amino-2-(diethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydrochromen-4-yl]-2-benzyl-1-cyanoguanidine Traditional Name: 1-[6-amino-2-(diethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]-2-benzyl-1-cyano-guanidine Formula: C24H31N5O4 MolecularWeight: 453.53404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1(C(C(C2=C(O1)C=CC(=C2)N)N(C#N)C(=NCC3=CC=CC=C3)N)O)C)OCC

Isomeric SMILES

CCOC(C1(C(C(C2=C(O1)C=CC(=C2)N)N(C#N)C(=NCC3=CC=CC=C3)N)O)C)OCC

InChI

InChI=1S/C24H31N5O4/c1-4-31-22(32-5-2)24(3)21(30)20(18-13-17(26)11-12-19(18)33-24)29(15-25)23(27)28-14-16-9-7-6-8-10-16/h6-13,20-22,30H,4-5,14,26H2,1-3H3,(H2,27,28)