5-[(4-carboxyphenyl)amino]-3-methyl-5-oxidanylidene-2-propyl-pentanoate

Systemtic Name: 5-[(4-carboxyphenyl)amino]-3-methyl-5-oxidanylidene-2-propyl-pentanoate Openeye Name: 5-(4-carboxyanilino)-3-methyl-5-oxo-2-propyl-pentanoate CAS Name: 5-(4-carboxyanilino)-3-methyl-5-oxo-2-propylpentanoate IUPAC Name: 5-(4-carboxyanilino)-3-methyl-5-oxo-2-propylpentanoate Traditional Name: 5-(4-carboxyanilino)-5-keto-3-methyl-2-propyl-valerate Formula: C16H20NO5- MolecularWeight: 306.3337

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)CC(=O)NC1=CC=C(C=C1)C(=O)O)C(=O)[O-]

Isomeric SMILES

CCCC(C(C)CC(=O)NC1=CC=C(C=C1)C(=O)O)C(=O)[O-]

InChI

InChI=1S/C16H21NO5/c1-3-4-13(16(21)22)10(2)9-14(18)17-12-7-5-11(6-8-12)15(19)20/h5-8,10,13H,3-4,9H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)/p-1