2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-(4-morpholin-4-ylcarbonyloxyphenyl)propanoic acid

Systemtic Name: 2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-(4-morpholin-4-ylcarbonyloxyphenyl)propanoic acid Openeye Name: 2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-3-[4-(morpholine-4-carbonyloxy)phenyl]propanoic acid CAS Name: 2-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-3-[4-[4-morpholinyl(oxo)methoxy]phenyl]propanoic acid IUPAC Name: 2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-[4-(morpholine-4-carbonyloxy)phenyl]propanoic acid Traditional Name: 2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-3-[4-(morpholine-4-carbonyloxy)phenyl]propionic acid Formula: C28H35N3O8 MolecularWeight: 541.5928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OC(=O)N2CCOCC2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OC(=O)N2CCOCC2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H35N3O8/c1-19(2)16-23(30-27(35)38-18-21-6-4-3-5-7-21)25(32)29-24(26(33)34)17-20-8-10-22(11-9-20)39-28(36)31-12-14-37-15-13-31/h3-11,19,23-24H,12-18H2,1-2H3,(H,29,32)(H,30,35)(H,33,34)