4-[(4-ethylphenyl)amino]-2-[2-(1H-indol-3-yl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-ethylphenyl)amino]-2-[2-(1H-indol-3-yl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-ethylanilino)-2-[2-(1H-indol-3-yl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-(4-ethylanilino)-2-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-(4-ethylanilino)-2-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-(4-ethylanilino)-2-[2-(1H-indol-3-yl)ethylamino]-4-keto-butyric acid Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H25N3O3/c1-2-15-7-9-17(10-8-15)25-21(26)13-20(22(27)28)23-12-11-16-14-24-19-6-4-3-5-18(16)19/h3-10,14,20,23-24H,2,11-13H2,1H3,(H,25,26)(H,27,28)