[(1S)-1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethyl]-propan-2-yl-azanium

Systemtic Name: [(1S)-1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethyl]-propan-2-yl-azanium Openeye Name: [(1S)-1-[5-(butanoylamino)-2-hydroxy-phenyl]ethyl]-isopropyl-ammonium CAS Name: [(1S)-1-[2-hydroxy-5-(1-oxobutylamino)phenyl]ethyl]-propan-2-ylammonium IUPAC Name: [(1S)-1-[5-(butanoylamino)-2-hydroxyphenyl]ethyl]-propan-2-ylazanium Traditional Name: [(1S)-1-(5-butyramido-2-hydroxy-phenyl)ethyl]-isopropyl-ammonium Formula: C15H25N2O2+ MolecularWeight: 265.3712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)O)C(C)[NH2+]C(C)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)O)[C@H](C)[NH2+]C(C)C

InChI

InChI=1S/C15H24N2O2/c1-5-6-15(19)17-12-7-8-14(18)13(9-12)11(4)16-10(2)3/h7-11,16,18H,5-6H2,1-4H3,(H,17,19)/p+1/t11-/m0/s1