5-[[1-[(5-bromanyl-1-methoxycarbonyl-indol-3-yl)methyl]piperidin-2-yl]methoxycarbonylamino]pentanoic acid

Systemtic Name: 5-[[1-[(5-bromanyl-1-methoxycarbonyl-indol-3-yl)methyl]piperidin-2-yl]methoxycarbonylamino]pentanoic acid Openeye Name: 5-[[1-[(5-bromo-1-methoxycarbonyl-indol-3-yl)methyl]-2-piperidyl]methoxycarbonylamino]pentanoic acid CAS Name: 5-[[[1-[(5-bromo-1-methoxycarbonyl-3-indolyl)methyl]-2-piperidinyl]methoxy-oxomethyl]amino]pentanoic acid IUPAC Name: 5-[[1-[(5-bromo-1-methoxycarbonylindol-3-yl)methyl]piperidin-2-yl]methoxycarbonylamino]pentanoic acid Traditional Name: 5-[[1-[(5-bromo-1-carbomethoxy-indol-3-yl)methyl]-2-piperidyl]methoxycarbonylamino]valeric acid Formula: C23H30BrN3O6 MolecularWeight: 524.4048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C=C(C2=C1C=CC(=C2)Br)CN3CCCCC3COC(=O)NCCCCC(=O)O

Isomeric SMILES

COC(=O)N1C=C(C2=C1C=CC(=C2)Br)CN3CCCCC3COC(=O)NCCCCC(=O)O

InChI

InChI=1S/C23H30BrN3O6/c1-32-23(31)27-14-16(19-12-17(24)8-9-20(19)27)13-26-11-5-3-6-18(26)15-33-22(30)25-10-4-2-7-21(28)29/h8-9,12,14,18H,2-7,10-11,13,15H2,1H3,(H,25,30)(H,28,29)