3-(2-azanylpyridin-3-yl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate

Systemtic Name: 3-(2-azanylpyridin-3-yl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate Openeye Name: 3-(2-amino-3-pyridyl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate CAS Name: 5-(4-carbamimidoylphenyl)pentanoic acid [3-(2-amino-3-pyridinyl)-1-oxopropyl] ester IUPAC Name: 3-(2-aminopyridin-3-yl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate Traditional Name: 5-(4-amidinophenyl)valeric acid 3-(2-amino-3-pyridyl)propanoyl ester Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O3/c21-19(22)15-9-7-14(8-10-15)4-1-2-6-17(25)27-18(26)12-11-16-5-3-13-24-20(16)23/h3,5,7-10,13H,1-2,4,6,11-12H2,(H3,21,22)(H2,23,24)