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methyl 3-[1-(2-methylpropyl)indol-3-yl]-2-(phenylmethoxycarbonylamino)butanoate

methyl 3-[1-(2-methylpropyl)indol-3-yl]-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name:methyl 3-[1-(2-methylpropyl)indol-3-yl]-2-(phenylmethoxycarbonylamino)butanoate
Openeye Name:methyl 2-(benzyloxycarbonylamino)-3-(1-isobutylindol-3-yl)butanoate
CAS Name:3-[1-(2-methylpropyl)-3-indolyl]-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester
IUPAC Name:methyl 3-[1-(2-methylpropyl)indol-3-yl]-2-(phenylmethoxycarbonylamino)butanoate
Traditional Name:2-(benzyloxycarbonylamino)-3-(1-isobutylindol-3-yl)butyric acid methyl ester
Formula: C25H30N2O4
MolecularWeight: 422.5167
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC=CC=C21)C(C)C(C(=O)OC)NC(=O)OCC3=CC=CC=C3


Isomeric SMILES

CC(C)CN1C=C(C2=CC=CC=C21)C(C)C(C(=O)OC)NC(=O)OCC3=CC=CC=C3


InChI

InChI=1S/C25H30N2O4/c1-17(2)14-27-15-21(20-12-8-9-13-22(20)27)18(3)23(24(28)30-4)26-25(29)31-16-19-10-6-5-7-11-19/h5-13,15,17-18,23H,14,16H2,1-4H3,(H,26,29)


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