[(1S)-1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethyl]-prop-2-enyl-azanium

Systemtic Name: [(1S)-1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(1S)-1-[5-(butanoylamino)-2-hydroxy-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-hydroxy-5-(1-oxobutylamino)phenyl]ethyl]-prop-2-enylammonium IUPAC Name: [(1S)-1-[5-(butanoylamino)-2-hydroxyphenyl]ethyl]-prop-2-enylazanium Traditional Name: allyl-[(1S)-1-(5-butyramido-2-hydroxy-phenyl)ethyl]ammonium Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2/c1-4-6-15(19)17-12-7-8-14(18)13(10-12)11(3)16-9-5-2/h5,7-8,10-11,16,18H,2,4,6,9H2,1,3H3,(H,17,19)/p+1/t11-/m0/s1