1-heptan-2-yl-2-phenethyl-guanidine

Systemtic Name: 1-heptan-2-yl-2-phenethyl-guanidine Openeye Name: 1-(1-methylhexyl)-2-phenethyl-guanidine CAS Name: 1-heptan-2-yl-2-phenethylguanidine IUPAC Name: 1-heptan-2-yl-2-phenethylguanidine Traditional Name: 1-(1-methylhexyl)-2-phenethyl-guanidine Formula: C16H27N3 MolecularWeight: 261.40568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=NCCC1=CC=CC=C1)N

Isomeric SMILES

CCCCCC(C)NC(=NCCC1=CC=CC=C1)N

InChI

InChI=1S/C16H27N3/c1-3-4-6-9-14(2)19-16(17)18-13-12-15-10-7-5-8-11-15/h5,7-8,10-11,14H,3-4,6,9,12-13H2,1-2H3,(H3,17,18,19)