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

Systemtic Name: 4-oxidanylidene-4-[2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethylamino]butanoate Openeye Name: 4-oxo-4-[2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethylamino]butanoate CAS Name: 4-oxo-4-[2-[4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]ethylamino]butanoate IUPAC Name: 4-oxo-4-[2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethylamino]butanoate Traditional Name: 4-keto-4-[2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethylamino]butyrate Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O4/c22-18(8-9-19(23)24)20-11-10-16-4-6-17(7-5-16)25-15-14-21-12-2-1-3-13-21/h4-7H,1-3,8-15H2,(H,20,22)(H,23,24)