[(1S)-3-ethoxy-3-oxidanylidene-1-[(3S)-1-phenylmethoxycarbonylpiperidin-3-yl]propyl]azanium

Systemtic Name: [(1S)-3-ethoxy-3-oxidanylidene-1-[(3S)-1-phenylmethoxycarbonylpiperidin-3-yl]propyl]azanium Openeye Name: [(1S)-1-[(3S)-1-benzyloxycarbonyl-3-piperidyl]-3-ethoxy-3-oxo-propyl]ammonium CAS Name: [(1S)-3-ethoxy-3-oxo-1-[(3S)-1-phenylmethoxycarbonyl-3-piperidinyl]propyl]ammonium IUPAC Name: [(1S)-3-ethoxy-3-oxo-1-[(3S)-1-phenylmethoxycarbonylpiperidin-3-yl]propyl]azanium Traditional Name: [(1S)-1-[(3S)-1-carbobenzoxy-3-piperidyl]-3-ethoxy-3-keto-propyl]ammonium Formula: C18H27N2O4+ MolecularWeight: 335.41798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1CCCN(C1)C(=O)OCC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CCOC(=O)C[C@@H]([C@H]1CCCN(C1)C(=O)OCC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C18H26N2O4/c1-2-23-17(21)11-16(19)15-9-6-10-20(12-15)18(22)24-13-14-7-4-3-5-8-14/h3-5,7-8,15-16H,2,6,9-13,19H2,1H3/p+1/t15-,16-/m0/s1