2-(1H-indol-3-yl)ethyl-[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: 2-(1H-indol-3-yl)ethyl-[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: 2-(1H-indol-3-yl)ethyl-[(1S)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: 2-(1H-indol-3-yl)ethyl-[(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]ammonium IUPAC Name: 2-(1H-indol-3-yl)ethyl-[(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]azanium Traditional Name: 2-(1H-indol-3-yl)ethyl-[(1S)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]ammonium Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)[NH2+]CCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C26H27N3O2/c1-18-12-13-24(31-2)23(16-18)29-26(30)25(19-8-4-3-5-9-19)27-15-14-20-17-28-22-11-7-6-10-21(20)22/h3-13,16-17,25,27-28H,14-15H2,1-2H3,(H,29,30)/p+1/t25-/m0/s1