(phenylmethyl) 3-(1H-indol-3-yl)-2-(pent-2-ynoxycarbonylamino)propanoate

Systemtic Name: (phenylmethyl) 3-(1H-indol-3-yl)-2-(pent-2-ynoxycarbonylamino)propanoate Openeye Name: benzyl 3-(1H-indol-3-yl)-2-(pent-2-ynoxycarbonylamino)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[oxo(pent-2-ynoxy)methyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1H-indol-3-yl)-2-(pent-2-ynoxycarbonylamino)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(pent-2-ynoxycarbonylamino)propionic acid benzyl ester Formula: C24H24N2O4 MolecularWeight: 404.45836

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCOC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC#CCOC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H24N2O4/c1-2-3-9-14-29-24(28)26-22(23(27)30-17-18-10-5-4-6-11-18)15-19-16-25-21-13-8-7-12-20(19)21/h4-8,10-13,16,22,25H,2,14-15,17H2,1H3,(H,26,28)