tert-butyl 3-[6-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-bis(oxidanyl)heptyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[6-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-bis(oxidanyl)heptyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[2-(tert-butoxycarbonylamino)-3,4-dihydroxy-6-methyl-heptyl]indole-1-carboxylate CAS Name: 3-[3,4-dihydroxy-6-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]heptyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3,4-dihydroxy-6-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]heptyl]indole-1-carboxylate Traditional Name: 3-[2-(tert-butoxycarbonylamino)-3,4-dihydroxy-6-methyl-heptyl]indole-1-carboxylic acid tert-butyl ester Formula: C26H40N2O6 MolecularWeight: 476.6056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(CC1=CN(C2=CC=CC=C21)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)O)O

Isomeric SMILES

CC(C)CC(C(C(CC1=CN(C2=CC=CC=C21)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)O)O

InChI

InChI=1S/C26H40N2O6/c1-16(2)13-21(29)22(30)19(27-23(31)33-25(3,4)5)14-17-15-28(24(32)34-26(6,7)8)20-12-10-9-11-18(17)20/h9-12,15-16,19,21-22,29-30H,13-14H2,1-8H3,(H,27,31)