5-aminocarbonyl-2-[1-azanyl-4-[2,5-bis(oxidanylidene)-4-(1-phenylethyl)pyrrolidin-3-yl]-1-oxidanylidene-butan-2-yl]heptanedioic acid

Systemtic Name: 5-aminocarbonyl-2-[1-azanyl-4-[2,5-bis(oxidanylidene)-4-(1-phenylethyl)pyrrolidin-3-yl]-1-oxidanylidene-butan-2-yl]heptanedioic acid Openeye Name: 5-carbamoyl-2-[1-carbamoyl-3-[2,5-dioxo-4-(1-phenylethyl)pyrrolidin-3-yl]propyl]heptanedioic acid CAS Name: 2-[1-amino-4-[2,5-dioxo-4-(1-phenylethyl)-3-pyrrolidinyl]-1-oxobutan-2-yl]-5-carbamoylheptanedioic acid IUPAC Name: 2-[1-amino-4-[2,5-dioxo-4-(1-phenylethyl)pyrrolidin-3-yl]-1-oxobutan-2-yl]-5-carbamoylheptanedioic acid Traditional Name: 5-carbamoyl-2-[1-carbamoyl-3-[2,5-diketo-4-(1-phenylethyl)pyrrolidin-3-yl]propyl]pimelic acid Formula: C24H31N3O8 MolecularWeight: 489.51824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(=O)NC1=O)CCC(C(CCC(CC(=O)O)C(=O)N)C(=O)O)C(=O)N)C2=CC=CC=C2

Isomeric SMILES

CC(C1C(C(=O)NC1=O)CCC(C(CCC(CC(=O)O)C(=O)N)C(=O)O)C(=O)N)C2=CC=CC=C2

InChI

InChI=1S/C24H31N3O8/c1-12(13-5-3-2-4-6-13)19-17(22(32)27-23(19)33)10-9-15(21(26)31)16(24(34)35)8-7-14(20(25)30)11-18(28)29/h2-6,12,14-17,19H,7-11H2,1H3,(H2,25,30)(H2,26,31)(H,28,29)(H,34,35)(H,27,32,33)