2-[azanyl-[3,5-di(propan-2-yl)phenyl]methyl]butanoate

Systemtic Name: 2-[azanyl-[3,5-di(propan-2-yl)phenyl]methyl]butanoate Openeye Name: 2-[amino-(3,5-diisopropylphenyl)methyl]butanoate CAS Name: 2-[amino-[3,5-di(propan-2-yl)phenyl]methyl]butanoate IUPAC Name: 2-[amino-[3,5-di(propan-2-yl)phenyl]methyl]butanoate Traditional Name: 2-[amino-(3,5-diisopropylphenyl)methyl]butyrate Formula: C17H26NO2- MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC(=CC(=C1)C(C)C)C(C)C)N)C(=O)[O-]

Isomeric SMILES

CCC(C(C1=CC(=CC(=C1)C(C)C)C(C)C)N)C(=O)[O-]

InChI

InChI=1S/C17H27NO2/c1-6-15(17(19)20)16(18)14-8-12(10(2)3)7-13(9-14)11(4)5/h7-11,15-16H,6,18H2,1-5H3,(H,19,20)/p-1