azanyl 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-2-oxidanyl-phenyl]propanoate

Systemtic Name: azanyl 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-2-oxidanyl-phenyl]propanoate Openeye Name: amino 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-2-hydroxy-phenyl]propanoate CAS Name: 3-[3-[5-(4-carbamimidoylphenyl)-1-oxopentyl]-2-hydroxyphenyl]propanoic acid amino ester IUPAC Name: amino 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-2-hydroxyphenyl]propanoate Traditional Name: 3-[3-[5-(4-amidinophenyl)pentanoyl]-2-hydroxy-phenyl]propionic acid amino ester Formula: C21H25N3O4 MolecularWeight: 383.4409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CCC(=O)ON)O)C(=O)CCCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1=CC(=C(C(=C1)CCC(=O)ON)O)C(=O)CCCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H25N3O4/c22-21(23)16-10-8-14(9-11-16)4-1-2-7-18(25)17-6-3-5-15(20(17)27)12-13-19(26)28-24/h3,5-6,8-11,27H,1-2,4,7,12-13,24H2,(H3,22,23)