3-pyridin-3-ylpropyl 2-[(3,3-dimethyl-2-oxidanylidene-pentanoyl)-propyl-amino]ethanoate

Systemtic Name: 3-pyridin-3-ylpropyl 2-[(3,3-dimethyl-2-oxidanylidene-pentanoyl)-propyl-amino]ethanoate Openeye Name: 3-(3-pyridyl)propyl 2-[(3,3-dimethyl-2-oxo-pentanoyl)-propyl-amino]acetate CAS Name: 2-[(3,3-dimethyl-1,2-dioxopentyl)-propylamino]acetic acid 3-(3-pyridinyl)propyl ester IUPAC Name: 3-pyridin-3-ylpropyl 2-[(3,3-dimethyl-2-oxopentanoyl)-propylamino]acetate Traditional Name: 2-[(2-keto-3,3-dimethyl-pentanoyl)-propyl-amino]acetic acid 3-(3-pyridyl)propyl ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)OCCCC1=CN=CC=C1)C(=O)C(=O)C(C)(C)CC

Isomeric SMILES

CCCN(CC(=O)OCCCC1=CN=CC=C1)C(=O)C(=O)C(C)(C)CC

InChI

InChI=1S/C20H30N2O4/c1-5-12-22(19(25)18(24)20(3,4)6-2)15-17(23)26-13-8-10-16-9-7-11-21-14-16/h7,9,11,14H,5-6,8,10,12-13,15H2,1-4H3