[(2S)-1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 1-ethylindole-3-carboxylate

Systemtic Name: [(2S)-1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 1-ethylindole-3-carboxylate Openeye Name: [(1S)-2-(4-ethoxyanilino)-1-methyl-2-oxo-ethyl] 1-ethylindole-3-carboxylate CAS Name: 1-ethyl-3-indolecarboxylic acid [(2S)-1-(4-ethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethoxyanilino)-1-oxopropan-2-yl] 1-ethylindole-3-carboxylate Traditional Name: 1-ethylindole-3-carboxylic acid [(1S)-2-keto-1-methyl-2-(p-phenetidino)ethyl] ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(=O)O[C@@H](C)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C22H24N2O4/c1-4-24-14-19(18-8-6-7-9-20(18)24)22(26)28-15(3)21(25)23-16-10-12-17(13-11-16)27-5-2/h6-15H,4-5H2,1-3H3,(H,23,25)/t15-/m0/s1