4-[(1-ethylindol-3-yl)methylamino]benzoic acid

Systemtic Name: 4-[(1-ethylindol-3-yl)methylamino]benzoic acid Openeye Name: 4-[(1-ethylindol-3-yl)methylamino]benzoic acid CAS Name: 4-[(1-ethyl-3-indolyl)methylamino]benzoic acid IUPAC Name: 4-[(1-ethylindol-3-yl)methylamino]benzoic acid Traditional Name: 4-[(1-ethylindol-3-yl)methylamino]benzoic acid Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)CNC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)CNC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H18N2O2/c1-2-20-12-14(16-5-3-4-6-17(16)20)11-19-15-9-7-13(8-10-15)18(21)22/h3-10,12,19H,2,11H2,1H3,(H,21,22)