2-[(4-butoxyphenyl)carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(4-butoxyphenyl)carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(4-butoxybenzoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(4-butoxybenzoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[(4-butoxybenzoyl)amino]-4-methyl-valeric acid Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C17H25NO4/c1-4-5-10-22-14-8-6-13(7-9-14)16(19)18-15(17(20)21)11-12(2)3/h6-9,12,15H,4-5,10-11H2,1-3H3,(H,18,19)(H,20,21)