2-[[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]azaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]azaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenyl-ethyl]ammonio]ethyl-dimethyl-ammonium CAS Name: 2-[[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl]ammonio]ethyl-dimethylammonium IUPAC Name: 2-[[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl]azaniumyl]ethyl-dimethylazanium Traditional Name: 2-[[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-keto-1-phenyl-ethyl]ammonio]ethyl-dimethyl-ammonium Formula: C22H29N3O+2 MolecularWeight: 351.48516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)[NH2+]CC[NH+](C)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)[C@H](C3=CC=CC=C3)[NH2+]CC[NH+](C)C

InChI

InChI=1S/C22H27N3O/c1-4-16-11-8-12-18-19(15-24-20(16)18)22(26)21(23-13-14-25(2)3)17-9-6-5-7-10-17/h5-12,15,21,23-24H,4,13-14H2,1-3H3/p+2/t21-/m0/s1