ethyl 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(indan-5-ylamino)-3-oxo-propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxopropyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxopropyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(indan-5-ylamino)-3-keto-propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C20H29N2O3+ MolecularWeight: 345.45586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C20H28N2O3/c1-2-25-20(24)16-8-11-22(12-9-16)13-10-19(23)21-18-7-6-15-4-3-5-17(15)14-18/h6-7,14,16H,2-5,8-13H2,1H3,(H,21,23)/p+1