methyl 1-[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-(2-phenyl-1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C23H25N2O3+ MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H24N2O3/c1-28-23(27)17-11-13-25(14-12-17)15-20(26)21-18-9-5-6-10-19(18)24-22(21)16-7-3-2-4-8-16/h2-10,17,24H,11-15H2,1H3/p+1