pyridin-2-yl 2-azanyl-2-[azanyl(phenyl)methyl]-3,6-bis(oxidanylidene)hexanoate

Systemtic Name: pyridin-2-yl 2-azanyl-2-[azanyl(phenyl)methyl]-3,6-bis(oxidanylidene)hexanoate Openeye Name: 2-pyridyl 2-amino-2-[amino(phenyl)methyl]-3,6-dioxo-hexanoate CAS Name: 2-amino-2-[amino(phenyl)methyl]-3,6-dioxohexanoic acid 2-pyridinyl ester IUPAC Name: pyridin-2-yl 2-amino-2-[amino(phenyl)methyl]-3,6-dioxohexanoate Traditional Name: 2-amino-2-[amino(phenyl)methyl]-3,6-diketo-hexanoic acid 2-pyridyl ester Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)CCC=O)(C(=O)OC2=CC=CC=N2)N)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)CCC=O)(C(=O)OC2=CC=CC=N2)N)N

InChI

InChI=1S/C18H19N3O4/c19-16(13-7-2-1-3-8-13)18(20,14(23)9-6-12-22)17(24)25-15-10-4-5-11-21-15/h1-5,7-8,10-12,16H,6,9,19-20H2