4-methyl-2-[phenethylcarbamoyl-[2-[3-(phenylmethoxymethyl)imidazol-4-yl]ethyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[phenethylcarbamoyl-[2-[3-(phenylmethoxymethyl)imidazol-4-yl]ethyl]amino]pentanoic acid Openeye Name: 2-[2-[3-(benzyloxymethyl)imidazol-4-yl]ethyl-(phenethylcarbamoyl)amino]-4-methyl-pentanoic acid CAS Name: 4-methyl-2-[[oxo-(phenethylamino)methyl]-[2-[3-(phenylmethoxymethyl)-4-imidazolyl]ethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[phenethylcarbamoyl-[2-[3-(phenylmethoxymethyl)imidazol-4-yl]ethyl]amino]pentanoic acid Traditional Name: 2-[2-[3-(benzoxymethyl)imidazol-4-yl]ethyl-(phenethylcarbamoyl)amino]-4-methyl-valeric acid Formula: C28H36N4O4 MolecularWeight: 492.60984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CN=CN1COCC2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CN=CN1COCC2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C28H36N4O4/c1-22(2)17-26(27(33)34)32(28(35)30-15-13-23-9-5-3-6-10-23)16-14-25-18-29-20-31(25)21-36-19-24-11-7-4-8-12-24/h3-12,18,20,22,26H,13-17,19,21H2,1-2H3,(H,30,35)(H,33,34)