2-[(3-azanyl-4-methyl-phenyl)carbonylamino]ethanoyl 3-(2-azanylpyridin-3-yl)propanoate

Systemtic Name: 2-[(3-azanyl-4-methyl-phenyl)carbonylamino]ethanoyl 3-(2-azanylpyridin-3-yl)propanoate Openeye Name: [2-[(3-amino-4-methyl-benzoyl)amino]acetyl] 3-(2-amino-3-pyridyl)propanoate CAS Name: 3-(2-amino-3-pyridinyl)propanoic acid [2-[[(3-amino-4-methylphenyl)-oxomethyl]amino]-1-oxoethyl] ester IUPAC Name: [2-[(3-amino-4-methylbenzoyl)amino]acetyl] 3-(2-aminopyridin-3-yl)propanoate Traditional Name: 3-(2-amino-3-pyridyl)propionic acid [2-[(3-amino-4-methyl-benzoyl)amino]acetyl] ester Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)OC(=O)CCC2=C(N=CC=C2)N)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)OC(=O)CCC2=C(N=CC=C2)N)N

InChI

InChI=1S/C18H20N4O4/c1-11-4-5-13(9-14(11)19)18(25)22-10-16(24)26-15(23)7-6-12-3-2-8-21-17(12)20/h2-5,8-9H,6-7,10,19H2,1H3,(H2,20,21)(H,22,25)