3-[4-[2-(1H-indol-7-ylcarbonylamino)ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(1H-indol-7-ylcarbonylamino)ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-(1H-indole-7-carbonylamino)ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[[1H-indol-7-yl(oxo)methyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-(1H-indole-7-carbonylamino)ethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-(1H-indole-7-carbonylamino)ethyl]phenyl]propionic acid Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)NCCC3=CC=C(C=C3)CCC(=O)O)NC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)NCCC3=CC=C(C=C3)CCC(=O)O)NC=C2

InChI

InChI=1S/C20H20N2O3/c23-18(24)9-8-14-4-6-15(7-5-14)10-12-22-20(25)17-3-1-2-16-11-13-21-19(16)17/h1-7,11,13,21H,8-10,12H2,(H,22,25)(H,23,24)