4-oxidanylidene-4-[[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate Openeye Name: 4-oxo-4-[[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate CAS Name: 4-oxo-4-[[2-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]methylamino]butanoate IUPAC Name: 4-oxo-4-[[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate Traditional Name: 4-keto-4-[[2-(2-piperidin-1-ium-1-ylethoxy)benzyl]amino]butyrate Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC2=CC=CC=C2CNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CCOC2=CC=CC=C2CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H26N2O4/c21-17(8-9-18(22)23)19-14-15-6-2-3-7-16(15)24-13-12-20-10-4-1-5-11-20/h2-3,6-7H,1,4-5,8-14H2,(H,19,21)(H,22,23)