undecyl 4-azanyl-3-phenyl-butanoate

Systemtic Name: undecyl 4-azanyl-3-phenyl-butanoate Openeye Name: undecyl 4-amino-3-phenyl-butanoate CAS Name: 4-amino-3-phenylbutanoic acid undecyl ester IUPAC Name: undecyl 4-amino-3-phenylbutanoate Traditional Name: 4-amino-3-phenyl-butyric acid undecyl ester Formula: C21H35NO2 MolecularWeight: 333.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)CC(CN)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCOC(=O)CC(CN)C1=CC=CC=C1

InChI

InChI=1S/C21H35NO2/c1-2-3-4-5-6-7-8-9-13-16-24-21(23)17-20(18-22)19-14-11-10-12-15-19/h10-12,14-15,20H,2-9,13,16-18,22H2,1H3