(2R)-4-oxidanylidene-2-(3-propan-2-yloxypropylazaniumyl)-4-[(2,4,6-trimethylphenyl)amino]butanoate

Systemtic Name: (2R)-4-oxidanylidene-2-(3-propan-2-yloxypropylazaniumyl)-4-[(2,4,6-trimethylphenyl)amino]butanoate Openeye Name: (2R)-2-(3-isopropoxypropylammonio)-4-oxo-4-(2,4,6-trimethylanilino)butanoate CAS Name: (2R)-4-oxo-2-(3-propan-2-yloxypropylammonio)-4-(2,4,6-trimethylanilino)butanoate IUPAC Name: (2R)-4-oxo-2-(3-propan-2-yloxypropylazaniumyl)-4-(2,4,6-trimethylanilino)butanoate Traditional Name: (2R)-2-(3-isopropoxypropylammonio)-4-keto-4-mesidino-butyrate Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CC(C(=O)[O-])[NH2+]CCCOC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[C@H](C(=O)[O-])[NH2+]CCCOC(C)C)C

InChI

InChI=1S/C19H30N2O4/c1-12(2)25-8-6-7-20-16(19(23)24)11-17(22)21-18-14(4)9-13(3)10-15(18)5/h9-10,12,16,20H,6-8,11H2,1-5H3,(H,21,22)(H,23,24)/t16-/m1/s1