2-[[2-[[1-(2-azanyl-3-methyl-butanoyl)pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-[[1-(2-azanyl-3-methyl-butanoyl)pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[[1-(2-amino-3-methyl-butanoyl)pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[[1-(2-amino-3-methyl-1-oxobutyl)-2-pyrrolidinyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[[1-(2-amino-3-methylbutanoyl)pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[[1-(2-amino-3-methyl-butanoyl)prolyl]amino]-3-methyl-pentanoyl]amino]-3-phenyl-propionic acid Formula: C25H38N4O5 MolecularWeight: 474.59302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C2CCCN2C(=O)C(C(C)C)N

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C2CCCN2C(=O)C(C(C)C)N

InChI

InChI=1S/C25H38N4O5/c1-5-16(4)21(23(31)27-18(25(33)34)14-17-10-7-6-8-11-17)28-22(30)19-12-9-13-29(19)24(32)20(26)15(2)3/h6-8,10-11,15-16,18-21H,5,9,12-14,26H2,1-4H3,(H,27,31)(H,28,30)(H,33,34)