(phenylmethyl) 2-(3-chloranylpropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: (phenylmethyl) 2-(3-chloranylpropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: benzyl 2-(3-chloropropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[3-chloropropoxy(oxo)methyl]amino]-3-(1H-indol-3-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-chloropropoxycarbonylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: 2-(3-chloropropoxycarbonylamino)-3-(1H-indol-3-yl)propionic acid benzyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCCCCl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCCCCl

InChI

InChI=1S/C22H23ClN2O4/c23-11-6-12-28-22(27)25-20(21(26)29-15-16-7-2-1-3-8-16)13-17-14-24-19-10-5-4-9-18(17)19/h1-5,7-10,14,20,24H,6,11-13,15H2,(H,25,27)