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octadecanoic acid; 2-phenylguanidine

octadecanoic acid; 2-phenylguanidine

Systemtic Name:octadecanoic acid; 2-phenylguanidine
Openeye Name:2-phenylguanidine; stearic acid
CAS Name:octadecanoic acid; 2-phenylguanidine
IUPAC Name:octadecanoic acid; 2-phenylguanidine
Traditional Name:2-phenylguanidine; stearic acid
Formula: C25H45N3O2
MolecularWeight: 419.6437
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.C1=CC=C(C=C1)N=C(N)N


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.C1=CC=C(C=C1)N=C(N)N


InChI

InChI=1S/C18H36O2.C7H9N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;8-7(9)10-6-4-2-1-3-5-6/h2-17H2,1H3,(H,19,20);1-5H,(H4,8,9,10)


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