2-[[3-[3-[(4-butylphenyl)methyl]imidazol-4-yl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3-[3-[(4-butylphenyl)methyl]imidazol-4-yl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[1-[[3-[(4-butylphenyl)methyl]imidazol-4-yl]methyl]-2-hydroxy-2-oxo-ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[3-[3-[(4-butylphenyl)methyl]-4-imidazolyl]-1-hydroxy-1-oxopropan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[3-[3-[(4-butylphenyl)methyl]imidazol-4-yl]-1-hydroxy-1-oxopropan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[1-[[3-(4-butylbenzyl)imidazol-4-yl]methyl]-2-hydroxy-2-keto-ethyl]amino]-4-methyl-valeric acid Formula: C23H33N3O4 MolecularWeight: 415.52582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CN2C=NC=C2CC(C(=O)O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)CN2C=NC=C2CC(C(=O)O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C23H33N3O4/c1-4-5-6-17-7-9-18(10-8-17)14-26-15-24-13-19(26)12-21(23(29)30)25-20(22(27)28)11-16(2)3/h7-10,13,15-16,20-21,25H,4-6,11-12,14H2,1-3H3,(H,27,28)(H,29,30)