[2-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxidanylidene-ethyl] 1H-indole-2-carboxylate

Systemtic Name: [2-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxidanylidene-ethyl] 1H-indole-2-carboxylate Openeye Name: [2-[[(1S)-1-(4-isobutylphenyl)ethyl]amino]-2-oxo-ethyl] 1H-indole-2-carboxylate CAS Name: 1H-indole-2-carboxylic acid [2-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethyl] 1H-indole-2-carboxylate Traditional Name: 1H-indole-2-carboxylic acid [2-[[(1S)-1-(4-isobutylphenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)COC(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)CC(C)C)NC(=O)COC(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C23H26N2O3/c1-15(2)12-17-8-10-18(11-9-17)16(3)24-22(26)14-28-23(27)21-13-19-6-4-5-7-20(19)25-21/h4-11,13,15-16,25H,12,14H2,1-3H3,(H,24,26)/t16-/m0/s1