[2-[bis(azanyl)methylideneamino]phenyl] 5-phenylpentanoate

Systemtic Name: [2-[bis(azanyl)methylideneamino]phenyl] 5-phenylpentanoate Openeye Name: (2-guanidinophenyl) 5-phenylpentanoate CAS Name: 5-phenylpentanoic acid [2-(diaminomethylideneamino)phenyl] ester IUPAC Name: [2-(diaminomethylideneamino)phenyl] 5-phenylpentanoate Traditional Name: 5-phenylvaleric acid (2-guanidinophenyl) ester Formula: C18H21N3O2 MolecularWeight: 311.37824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC(=O)OC2=CC=CC=C2N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCC(=O)OC2=CC=CC=C2N=C(N)N

InChI

InChI=1S/C18H21N3O2/c19-18(20)21-15-11-5-6-12-16(15)23-17(22)13-7-4-10-14-8-2-1-3-9-14/h1-3,5-6,8-9,11-12H,4,7,10,13H2,(H4,19,20,21)