2-[2-[2-[[(2R)-2-[[(2S)-1-(2-methoxy-2-oxidanylidene-ethanoyl)pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoyl]amino]ethanoylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[2-[2-[[(2R)-2-[[(2S)-1-(2-methoxy-2-oxidanylidene-ethanoyl)pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoyl]amino]ethanoylamino]phenoxy]ethanoic acid Openeye Name: 2-[2-[[2-[[(2R)-2-[[(2S)-1-(2-methoxy-2-oxo-acetyl)pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]phenoxy]acetic acid CAS Name: 2-[2-[[2-[[(2R)-2-[[[(2S)-1-(2-methoxy-1,2-dioxoethyl)-2-pyrrolidinyl]-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-1-oxoethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[2-[[2-[[(2R)-2-[[(2S)-1-(2-methoxy-2-oxoacetyl)pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]phenoxy]acetic acid Traditional Name: 2-[2-[[2-[[(2R)-2-[[(2S)-1-methoxalylprolyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]phenoxy]acetic acid Formula: C27H30N4O9 MolecularWeight: 554.5485

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)NCC(=O)NC3=CC=CC=C3OCC(=O)O

Isomeric SMILES

COC(=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC2=CC=CC=C2)C(=O)NCC(=O)NC3=CC=CC=C3OCC(=O)O

InChI

InChI=1S/C27H30N4O9/c1-39-27(38)26(37)31-13-7-11-20(31)25(36)30-19(14-17-8-3-2-4-9-17)24(35)28-15-22(32)29-18-10-5-6-12-21(18)40-16-23(33)34/h2-6,8-10,12,19-20H,7,11,13-16H2,1H3,(H,28,35)(H,29,32)(H,30,36)(H,33,34)/t19-,20+/m1/s1