4-[bis(phenylmethyl)azaniumyl]butanoate

Systemtic Name: 4-[bis(phenylmethyl)azaniumyl]butanoate Openeye Name: 4-(dibenzylammonio)butanoate CAS Name: 4-[bis(phenylmethyl)ammonio]butanoate IUPAC Name: 4-(dibenzylazaniumyl)butanoate Traditional Name: 4-(dibenzylammonio)butyrate Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CCCC(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CCCC(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C18H21NO2/c20-18(21)12-7-13-19(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-6,8-11H,7,12-15H2,(H,20,21)