[(1S)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(1S)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: [(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl]-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: [(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: [(1S)-2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl]-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C24H31N3O+2 MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]C(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+][C@@H](C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O/c1-2-14-27-15-12-19(13-16-27)26-23(18-8-4-3-5-9-18)24(28)21-17-25-22-11-7-6-10-20(21)22/h3-11,17,19,23,25-26H,2,12-16H2,1H3/p+2/t23-/m0/s1