2-[[4-chloranyl-3-[(2-methoxyphenyl)carbonylamino]phenyl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-chloranyl-3-[(2-methoxyphenyl)carbonylamino]phenyl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-chloro-3-[(2-methoxybenzoyl)amino]benzoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[4-chloro-3-[[(2-methoxyphenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[4-chloro-3-[(2-methoxybenzoyl)amino]benzoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[4-chloro-3-(o-anisoylamino)benzoyl]amino]-4-methyl-valeric acid Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C21H23ClN2O5/c1-12(2)10-17(21(27)28)24-19(25)13-8-9-15(22)16(11-13)23-20(26)14-6-4-5-7-18(14)29-3/h4-9,11-12,17H,10H2,1-3H3,(H,23,26)(H,24,25)(H,27,28)