tert-butyl 2-[2-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-heptanoyl]amino]ethanoylamino]-2-phenyl-ethanoate

Systemtic Name: tert-butyl 2-[2-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-heptanoyl]amino]ethanoylamino]-2-phenyl-ethanoate Openeye Name: tert-butyl 2-[[2-[[3-(tert-butoxycarbonylamino)-2-hydroxy-heptanoyl]amino]acetyl]amino]-2-phenyl-acetate CAS Name: 2-[[2-[[2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoheptyl]amino]-1-oxoethyl]amino]-2-phenylacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-[[2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoyl]amino]acetyl]amino]-2-phenylacetate Traditional Name: 2-[[2-[[3-(tert-butoxycarbonylamino)-2-hydroxy-heptanoyl]amino]acetyl]amino]-2-phenyl-acetic acid tert-butyl ester Formula: C26H41N3O7 MolecularWeight: 507.61964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)OC(C)(C)C)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)OC(C)(C)C)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H41N3O7/c1-8-9-15-18(28-24(34)36-26(5,6)7)21(31)22(32)27-16-19(30)29-20(17-13-11-10-12-14-17)23(33)35-25(2,3)4/h10-14,18,20-21,31H,8-9,15-16H2,1-7H3,(H,27,32)(H,28,34)(H,29,30)