2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[(2-amino-4-methylpentanoyl)amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-valeric acid Formula: C21H33N3O4 MolecularWeight: 391.50442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)O)N

InChI

InChI=1S/C21H33N3O4/c1-13(2)10-16(22)19(25)23-17(12-15-8-6-5-7-9-15)20(26)24-18(21(27)28)11-14(3)4/h5-9,13-14,16-18H,10-12,22H2,1-4H3,(H,23,25)(H,24,26)(H,27,28)