1-cyano-2-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octyl-guanidine

Systemtic Name: 1-cyano-2-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octyl-guanidine Openeye Name: 1-cyano-2-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-octyl-guanidine CAS Name: 1-cyano-2-[(4-hydroxy-3-methoxyphenyl)methyl]-3-octylguanidine IUPAC Name: 1-cyano-2-[(4-hydroxy-3-methoxyphenyl)methyl]-3-octylguanidine Traditional Name: 1-cyano-3-octyl-2-vanillyl-guanidine Formula: C18H28N4O2 MolecularWeight: 332.44052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=NCC1=CC(=C(C=C1)O)OC)NC#N

Isomeric SMILES

CCCCCCCCNC(=NCC1=CC(=C(C=C1)O)OC)NC#N

InChI

InChI=1S/C18H28N4O2/c1-3-4-5-6-7-8-11-20-18(22-14-19)21-13-15-9-10-16(23)17(12-15)24-2/h9-10,12,23H,3-8,11,13H2,1-2H3,(H2,20,21,22)