methyl 2-(chloromethyl)-3-[methyl-[5-[(2-methylphenyl)carbamoyl]pyridin-2-yl]carbonyl-amino]propanoate

Systemtic Name: methyl 2-(chloromethyl)-3-[methyl-[5-[(2-methylphenyl)carbamoyl]pyridin-2-yl]carbonyl-amino]propanoate Openeye Name: methyl 2-(chloromethyl)-3-[methyl-[5-(o-tolylcarbamoyl)pyridine-2-carbonyl]amino]propanoate CAS Name: 2-(chloromethyl)-3-[methyl-[[5-[(2-methylanilino)-oxomethyl]-2-pyridinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-(chloromethyl)-3-[methyl-[5-[(2-methylphenyl)carbamoyl]pyridine-2-carbonyl]amino]propanoate Traditional Name: 2-(chloromethyl)-3-[methyl-[5-(o-tolylcarbamoyl)picolinoyl]amino]propionic acid methyl ester Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CN=C(C=C2)C(=O)N(C)CC(CCl)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CN=C(C=C2)C(=O)N(C)CC(CCl)C(=O)OC

InChI

InChI=1S/C20H22ClN3O4/c1-13-6-4-5-7-16(13)23-18(25)14-8-9-17(22-11-14)19(26)24(2)12-15(10-21)20(27)28-3/h4-9,11,15H,10,12H2,1-3H3,(H,23,25)