ethyl 4-methyl-3-[[1-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]pyrrolidin-2-yl]carbonylamino]-2-oxidanyl-pentanimidate

Systemtic Name: ethyl 4-methyl-3-[[1-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]pyrrolidin-2-yl]carbonylamino]-2-oxidanyl-pentanimidate Openeye Name: ethyl 3-[[1-[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]pyrrolidine-2-carbonyl]amino]-2-hydroxy-4-methyl-pentanimidate CAS Name: 2-hydroxy-4-methyl-3-[[[1-[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]-2-pyrrolidinyl]-oxomethyl]amino]pentanimidic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-4-methyl-3-[[1-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]pyrrolidine-2-carbonyl]amino]pentanimidate Traditional Name: 3-[[1-[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]prolyl]amino]-2-hydroxy-4-methyl-valerimidic acid ethyl ester Formula: C26H40N4O6 MolecularWeight: 504.619

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=N)C(C(C(C)C)NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=N)C(C(C(C)C)NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C26H40N4O6/c1-6-35-23(27)22(31)20(16(2)3)28-24(32)19-13-10-14-30(19)25(33)21(17(4)5)29-26(34)36-15-18-11-8-7-9-12-18/h7-9,11-12,16-17,19-22,27,31H,6,10,13-15H2,1-5H3,(H,28,32)(H,29,34)