(2S)-4-methyl-2-[[(2R,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[[(2R,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate Openeye Name: (2S)-2-[[(2R,3S)-2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[(2R,3S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[[(2R,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate Traditional Name: (2S)-2-[[(2R,3S)-2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-4-methyl-valerate Formula: C20H29N2O5- MolecularWeight: 377.45466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC(C)C)C(=O)[O-])NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)N[C@@H](CC(C)C)C(=O)[O-])NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C20H30N2O5/c1-5-14(4)17(18(23)21-16(19(24)25)11-13(2)3)22-20(26)27-12-15-9-7-6-8-10-15/h6-10,13-14,16-17H,5,11-12H2,1-4H3,(H,21,23)(H,22,26)(H,24,25)/p-1/t14-,16-,17+/m0/s1