[(2S)-1-oxidanylidene-1-(pentylamino)propan-2-yl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-(pentylamino)propan-2-yl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-(pentylamino)ethyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(2S)-1-oxo-1-(pentylamino)propan-2-yl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(2S)-1-oxo-1-(pentylamino)propan-2-yl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(1S)-2-(amylamino)-2-keto-1-methyl-ethyl]-[(1R)-1-phenylethyl]ammonium Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)[NH2+]C(C)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O/c1-4-5-9-12-17-16(19)14(3)18-13(2)15-10-7-6-8-11-15/h6-8,10-11,13-14,18H,4-5,9,12H2,1-3H3,(H,17,19)/p+1/t13-,14+/m1/s1