2-[1-[2-acetyloxycarbonyl-3-azanyl-5-oxidanylidene-5-(pentylamino)-2-phenoxy-pentanoyl]oxycyclopentyl]ethanoic acid

Systemtic Name: 2-[1-[2-acetyloxycarbonyl-3-azanyl-5-oxidanylidene-5-(pentylamino)-2-phenoxy-pentanoyl]oxycyclopentyl]ethanoic acid Openeye Name: 2-[1-[2-acetoxycarbonyl-3-amino-5-oxo-5-(pentylamino)-2-phenoxy-pentanoyl]oxycyclopentyl]acetic acid CAS Name: 2-[1-[2-[acetyloxy(oxo)methyl]-3-amino-1,5-dioxo-5-(pentylamino)-2-phenoxypentoxy]cyclopentyl]acetic acid IUPAC Name: 2-[1-[2-acetyloxycarbonyl-3-amino-5-oxo-5-(pentylamino)-2-phenoxypentanoyl]oxycyclopentyl]acetic acid Traditional Name: 2-[1-[2-acetoxycarbonyl-3-amino-5-(amylamino)-5-keto-2-phenoxy-pentanoyl]oxycyclopentyl]acetic acid Formula: C26H36N2O9 MolecularWeight: 520.57204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CC(C(C(=O)OC(=O)C)(C(=O)OC1(CCCC1)CC(=O)O)OC2=CC=CC=C2)N

Isomeric SMILES

CCCCCNC(=O)CC(C(C(=O)OC(=O)C)(C(=O)OC1(CCCC1)CC(=O)O)OC2=CC=CC=C2)N

InChI

InChI=1S/C26H36N2O9/c1-3-4-10-15-28-21(30)16-20(27)26(23(33)35-18(2)29,36-19-11-6-5-7-12-19)24(34)37-25(17-22(31)32)13-8-9-14-25/h5-7,11-12,20H,3-4,8-10,13-17,27H2,1-2H3,(H,28,30)(H,31,32)