N-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]-3-oxidanyl-2-phenyl-propanamide hydrochloride

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]-3-oxidanyl-2-phenyl-propanamide hydrochloride Openeye Name: N-[(4-guanidinophenyl)methyl]-3-hydroxy-2-phenyl-propanamide hydrochloride CAS Name: N-[[4-(diaminomethylideneamino)phenyl]methyl]-3-hydroxy-2-phenylpropanamide hydrochloride IUPAC Name: N-[[4-(diaminomethylideneamino)phenyl]methyl]-3-hydroxy-2-phenylpropanamide hydrochloride Traditional Name: N-(4-guanidinobenzyl)-3-hydroxy-2-phenyl-propionamide hydrochloride Formula: C17H21ClN4O2 MolecularWeight: 348.82724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)C(=O)NCC2=CC=C(C=C2)N=C(N)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CO)C(=O)NCC2=CC=C(C=C2)N=C(N)N.Cl

InChI

InChI=1S/C17H20N4O2.ClH/c18-17(19)21-14-8-6-12(7-9-14)10-20-16(23)15(11-22)13-4-2-1-3-5-13;/h1-9,15,22H,10-11H2,(H,20,23)(H4,18,19,21);1H