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

Systemtic Name: 4-oxidanylidene-4-[[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate Openeye Name: 4-oxo-4-[[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate CAS Name: 4-oxo-4-[[4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]methylamino]butanoate IUPAC Name: 4-oxo-4-[[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methylamino]butanoate Traditional Name: 4-keto-4-[[4-(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=C(C=C2)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CCOC2=CC=C(C=C2)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H26N2O4/c21-17(8-9-18(22)23)19-14-15-4-6-16(7-5-15)24-13-12-20-10-2-1-3-11-20/h4-7H,1-3,8-14H2,(H,19,21)(H,22,23)