[(1R)-1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethyl]-pentyl-azanium

Systemtic Name: [(1R)-1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethyl]-pentyl-azanium Openeye Name: [(1R)-1-[5-(butanoylamino)-2-hydroxy-phenyl]ethyl]-pentyl-ammonium CAS Name: [(1R)-1-[2-hydroxy-5-(1-oxobutylamino)phenyl]ethyl]-pentylammonium IUPAC Name: [(1R)-1-[5-(butanoylamino)-2-hydroxyphenyl]ethyl]-pentylazanium Traditional Name: amyl-[(1R)-1-(5-butyramido-2-hydroxy-phenyl)ethyl]ammonium Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]C(C)C1=C(C=CC(=C1)NC(=O)CCC)O

Isomeric SMILES

CCCCC[NH2+][C@H](C)C1=C(C=CC(=C1)NC(=O)CCC)O

InChI

InChI=1S/C17H28N2O2/c1-4-6-7-11-18-13(3)15-12-14(9-10-16(15)20)19-17(21)8-5-2/h9-10,12-13,18,20H,4-8,11H2,1-3H3,(H,19,21)/p+1/t13-/m1/s1