diethyl 2-[[5-(prop-2-ynylamino)pyridin-2-yl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[5-(prop-2-ynylamino)pyridin-2-yl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[5-(prop-2-ynylamino)pyridine-2-carbonyl]amino]pentanedioate CAS Name: 2-[[oxo-[5-(prop-2-ynylamino)-2-pyridinyl]methyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[5-(prop-2-ynylamino)pyridine-2-carbonyl]amino]pentanedioate Traditional Name: 2-[[5-(propargylamino)picolinoyl]amino]glutaric acid diethyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=NC=C(C=C1)NCC#C

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=NC=C(C=C1)NCC#C

InChI

InChI=1S/C18H23N3O5/c1-4-11-19-13-7-8-14(20-12-13)17(23)21-15(18(24)26-6-3)9-10-16(22)25-5-2/h1,7-8,12,15,19H,5-6,9-11H2,2-3H3,(H,21,23)