3-azanyl-2-[2-(carboxymethyloxy)ethanoyloxycarbonyl]-5-oxidanylidene-5-(pentylamino)-2-phenoxy-pentanoic acid

Systemtic Name: 3-azanyl-2-[2-(carboxymethyloxy)ethanoyloxycarbonyl]-5-oxidanylidene-5-(pentylamino)-2-phenoxy-pentanoic acid Openeye Name: 3-amino-2-[2-(carboxymethyloxy)acetyl]oxycarbonyl-5-oxo-5-(pentylamino)-2-phenoxy-pentanoic acid CAS Name: 3-amino-2-[[2-(carboxymethyloxy)-1-oxoethoxy]-oxomethyl]-5-oxo-5-(pentylamino)-2-phenoxypentanoic acid IUPAC Name: 3-amino-2-[2-(carboxymethyloxy)acetyl]oxycarbonyl-5-oxo-5-(pentylamino)-2-phenoxypentanoic acid Traditional Name: 3-amino-5-(amylamino)-2-[2-(carboxymethyloxy)acetyl]oxycarbonyl-5-keto-2-phenoxy-valeric acid Formula: C21H28N2O10 MolecularWeight: 468.45442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CC(C(C(=O)O)(C(=O)OC(=O)COCC(=O)O)OC1=CC=CC=C1)N

Isomeric SMILES

CCCCCNC(=O)CC(C(C(=O)O)(C(=O)OC(=O)COCC(=O)O)OC1=CC=CC=C1)N

InChI

InChI=1S/C21H28N2O10/c1-2-3-7-10-23-16(24)11-15(22)21(19(28)29,33-14-8-5-4-6-9-14)20(30)32-18(27)13-31-12-17(25)26/h4-6,8-9,15H,2-3,7,10-13,22H2,1H3,(H,23,24)(H,25,26)(H,28,29)