2-[[2-[2-[2-[[2,6-bis(chloranyl)phenyl]amino]phenyl]ethanoylamino]-3-methyl-pentanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[2-[2-[[2,6-bis(chloranyl)phenyl]amino]phenyl]ethanoylamino]-3-methyl-pentanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[[2-[2-(2,6-dichloroanilino)phenyl]acetyl]amino]-3-methyl-pentanoyl]amino]acetic acid CAS Name: 2-[[2-[[2-[2-(2,6-dichloroanilino)phenyl]-1-oxoethyl]amino]-3-methyl-1-oxopentyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-[2-(2,6-dichloroanilino)phenyl]acetyl]amino]-3-methylpentanoyl]amino]acetic acid Traditional Name: 2-[[2-[[2-[2-(2,6-dichloroanilino)phenyl]acetyl]amino]-3-methyl-pentanoyl]amino]acetic acid Formula: C22H25Cl2N3O4 MolecularWeight: 466.3576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(=O)O)NC(=O)CC1=CC=CC=C1NC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CCC(C)C(C(=O)NCC(=O)O)NC(=O)CC1=CC=CC=C1NC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O4/c1-3-13(2)20(22(31)25-12-19(29)30)27-18(28)11-14-7-4-5-10-17(14)26-21-15(23)8-6-9-16(21)24/h4-10,13,20,26H,3,11-12H2,1-2H3,(H,25,31)(H,27,28)(H,29,30)