1-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]-2-cyano-1-pyridin-4-yl-guanidine

Systemtic Name: 1-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]-2-cyano-1-pyridin-4-yl-guanidine Openeye Name: 1-[3-(4-chlorophenoxy)-2-hydroxy-propyl]-2-cyano-1-(4-pyridyl)guanidine CAS Name: 1-[3-(4-chlorophenoxy)-2-hydroxypropyl]-2-cyano-1-pyridin-4-ylguanidine IUPAC Name: 1-[3-(4-chlorophenoxy)-2-hydroxypropyl]-2-cyano-1-pyridin-4-ylguanidine Traditional Name: 1-[3-(4-chlorophenoxy)-2-hydroxy-propyl]-2-cyano-1-(4-pyridyl)guanidine Formula: C16H16ClN5O2 MolecularWeight: 345.78354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(CN(C2=CC=NC=C2)C(=NC#N)N)O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCC(CN(C2=CC=NC=C2)C(=NC#N)N)O)Cl

InChI

InChI=1S/C16H16ClN5O2/c17-12-1-3-15(4-2-12)24-10-14(23)9-22(16(19)21-11-18)13-5-7-20-8-6-13/h1-8,14,23H,9-10H2,(H2,19,21)