1-cyano-2-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethyl]-1-phenyl-guanidine

Systemtic Name: 1-cyano-2-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethyl]-1-phenyl-guanidine Openeye Name: 1-cyano-2-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethyl]-1-phenyl-guanidine CAS Name: 1-cyano-2-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethyl]-1-phenylguanidine IUPAC Name: 1-cyano-2-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethyl]-1-phenylguanidine Traditional Name: 1-cyano-2-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethyl]-1-phenyl-guanidine Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C#N)C(=NCCNCC(COC2=CC=CC=C2C#N)O)N

Isomeric SMILES

C1=CC=C(C=C1)N(C#N)C(=NCCNCC(COC2=CC=CC=C2C#N)O)N

InChI

InChI=1S/C20H22N6O2/c21-12-16-6-4-5-9-19(16)28-14-18(27)13-24-10-11-25-20(23)26(15-22)17-7-2-1-3-8-17/h1-9,18,24,27H,10-11,13-14H2,(H2,23,25)