4-oxidanylidene-4-[(3-propan-2-yloxyphenyl)amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[(3-propan-2-yloxyphenyl)amino]butanoate Openeye Name: 4-(3-isopropoxyanilino)-4-oxo-butanoate CAS Name: 4-oxo-4-(3-propan-2-yloxyanilino)butanoate IUPAC Name: 4-oxo-4-(3-propan-2-yloxyanilino)butanoate Traditional Name: 4-(3-isopropoxyanilino)-4-keto-butyrate Formula: C13H16NO4- MolecularWeight: 250.27044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H17NO4/c1-9(2)18-11-5-3-4-10(8-11)14-12(15)6-7-13(16)17/h3-5,8-9H,6-7H2,1-2H3,(H,14,15)(H,16,17)/p-1