(2R)-2-(3-methoxypropylazaniumyl)-4-oxidanylidene-4-(pyridin-3-ylamino)butanoate

Systemtic Name: (2R)-2-(3-methoxypropylazaniumyl)-4-oxidanylidene-4-(pyridin-3-ylamino)butanoate Openeye Name: (2R)-2-(3-methoxypropylammonio)-4-oxo-4-(3-pyridylamino)butanoate CAS Name: (2R)-2-(3-methoxypropylammonio)-4-oxo-4-(3-pyridinylamino)butanoate IUPAC Name: (2R)-2-(3-methoxypropylazaniumyl)-4-oxo-4-(pyridin-3-ylamino)butanoate Traditional Name: (2R)-4-keto-2-(3-methoxypropylammonio)-4-(3-pyridylamino)butyrate Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH2+]C(CC(=O)NC1=CN=CC=C1)C(=O)[O-]

Isomeric SMILES

COCCC[NH2+][C@H](CC(=O)NC1=CN=CC=C1)C(=O)[O-]

InChI

InChI=1S/C13H19N3O4/c1-20-7-3-6-15-11(13(18)19)8-12(17)16-10-4-2-5-14-9-10/h2,4-5,9,11,15H,3,6-8H2,1H3,(H,16,17)(H,18,19)/t11-/m1/s1