2-[(3,4-diethoxyphenyl)carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(3,4-diethoxyphenyl)carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(3,4-diethoxybenzoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(3,4-diethoxybenzoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[(3,4-diethoxybenzoyl)amino]-4-methyl-valeric acid Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(CC(C)C)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(CC(C)C)C(=O)O)OCC

InChI

InChI=1S/C17H25NO5/c1-5-22-14-8-7-12(10-15(14)23-6-2)16(19)18-13(17(20)21)9-11(3)4/h7-8,10-11,13H,5-6,9H2,1-4H3,(H,18,19)(H,20,21)