4-methyl-2-[2-[4-(phenylcarbamoylamino)phenyl]ethanoylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[2-[4-(phenylcarbamoylamino)phenyl]ethanoylamino]pentanoic acid Openeye Name: 4-methyl-2-[[2-[4-(phenylcarbamoylamino)phenyl]acetyl]amino]pentanoic acid CAS Name: 2-[[2-[4-[[anilino(oxo)methyl]amino]phenyl]-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 4-methyl-2-[[2-[4-(phenylcarbamoylamino)phenyl]acetyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[2-[4-(phenylcarbamoylamino)phenyl]acetyl]amino]valeric acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O4/c1-14(2)12-18(20(26)27)24-19(25)13-15-8-10-17(11-9-15)23-21(28)22-16-6-4-3-5-7-16/h3-11,14,18H,12-13H2,1-2H3,(H,24,25)(H,26,27)(H2,22,23,28)