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

Systemtic Name: 2-[[2-[[1-(2-azanyl-3-phenyl-propyl)pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[2-[[1-(2-amino-3-phenyl-propyl)pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[2-[[[1-(2-amino-3-phenylpropyl)-2-pyrrolidinyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[2-[[1-(2-amino-3-phenylpropyl)pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[2-[[1-(2-amino-3-phenyl-propyl)prolyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-propionic acid Formula: C23H36N4O5 MolecularWeight: 448.55574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CO)C(=O)O)NC(=O)C1CCCN1CC(CC2=CC=CC=C2)N

Isomeric SMILES

CCC(C)C(C(=O)NC(CO)C(=O)O)NC(=O)C1CCCN1CC(CC2=CC=CC=C2)N

InChI

InChI=1S/C23H36N4O5/c1-3-15(2)20(22(30)25-18(14-28)23(31)32)26-21(29)19-10-7-11-27(19)13-17(24)12-16-8-5-4-6-9-16/h4-6,8-9,15,17-20,28H,3,7,10-14,24H2,1-2H3,(H,25,30)(H,26,29)(H,31,32)