1,2-bis[4-(1-oxidanylbutyl)phenyl]guanidine

Systemtic Name: 1,2-bis[4-(1-oxidanylbutyl)phenyl]guanidine Openeye Name: 1,2-bis[4-(1-hydroxybutyl)phenyl]guanidine CAS Name: 1,2-bis[4-(1-hydroxybutyl)phenyl]guanidine IUPAC Name: 1,2-bis[4-(1-hydroxybutyl)phenyl]guanidine Traditional Name: 1,2-bis[4-(1-hydroxybutyl)phenyl]guanidine Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C(CCC)O)N)O

Isomeric SMILES

CCCC(C1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C(CCC)O)N)O

InChI

InChI=1S/C21H29N3O2/c1-3-5-19(25)15-7-11-17(12-8-15)23-21(22)24-18-13-9-16(10-14-18)20(26)6-4-2/h7-14,19-20,25-26H,3-6H2,1-2H3,(H3,22,23,24)