[(2S,3S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[ethyl-[2-(4-pyridyl)ethyl]carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[ethyl-[2-(4-pyridyl)ethyl]carbamoyl]-2-methyl-butyl]ammonium Formula: C15H26N3O+ MolecularWeight: 264.38644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(CC)CCC1=CC=NC=C1)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N(CC)CCC1=CC=NC=C1)[NH3+]

InChI

InChI=1S/C15H25N3O/c1-4-12(3)14(16)15(19)18(5-2)11-8-13-6-9-17-10-7-13/h6-7,9-10,12,14H,4-5,8,11,16H2,1-3H3/p+1/t12-,14-/m0/s1