methyl (2S)-4-methyl-2-[[3-(2-methylpropanoylamino)phenyl]carbonylamino]pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-[[3-(2-methylpropanoylamino)phenyl]carbonylamino]pentanoate Openeye Name: methyl (2S)-4-methyl-2-[[3-(2-methylpropanoylamino)benzoyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[[3-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-[[3-(2-methylpropanoylamino)benzoyl]amino]pentanoate Traditional Name: (2S)-2-[[3-(isobutyrylamino)benzoyl]amino]-4-methyl-valeric acid methyl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC(=CC=C1)NC(=O)C(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)C1=CC(=CC=C1)NC(=O)C(C)C

InChI

InChI=1S/C18H26N2O4/c1-11(2)9-15(18(23)24-5)20-17(22)13-7-6-8-14(10-13)19-16(21)12(3)4/h6-8,10-12,15H,9H2,1-5H3,(H,19,21)(H,20,22)/t15-/m0/s1