(2S)-5-[(2-ethoxycarbonylcyclopropyl)carbonylamino]-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-[(2-ethoxycarbonylcyclopropyl)carbonylamino]-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-5-[(2-ethoxycarbonylcyclopropanecarbonyl)amino]pentanoic acid CAS Name: (2S)-5-[[(2-ethoxycarbonylcyclopropyl)-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-5-[(2-ethoxycarbonylcyclopropanecarbonyl)amino]-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-[(2-carbethoxycyclopropanecarbonyl)amino]valeric acid Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1C(=O)NCCCC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CC1C(=O)NCCC[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O7/c1-2-28-19(26)15-11-14(15)17(23)21-10-6-9-16(18(24)25)22-20(27)29-12-13-7-4-3-5-8-13/h3-5,7-8,14-16H,2,6,9-12H2,1H3,(H,21,23)(H,22,27)(H,24,25)/t14?,15?,16-/m0/s1