[3-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-3-oxidanylidene-propyl]-[(1S)-1-phenylethyl]azanium

Systemtic Name: [3-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-3-oxidanylidene-propyl]-[(1S)-1-phenylethyl]azanium Openeye Name: [3-[(3S)-3-ethoxycarbonyl-1-piperidyl]-3-oxo-propyl]-[(1S)-1-phenylethyl]ammonium CAS Name: [3-[(3S)-3-ethoxycarbonyl-1-piperidinyl]-3-oxopropyl]-[(1S)-1-phenylethyl]ammonium IUPAC Name: [3-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-3-oxopropyl]-[(1S)-1-phenylethyl]azanium Traditional Name: [3-[(3S)-3-carbethoxypiperidino]-3-keto-propyl]-[(1S)-1-phenylethyl]ammonium Formula: C19H29N2O3+ MolecularWeight: 333.44516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CC[NH2+]C(C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)CC[NH2+][C@@H](C)C2=CC=CC=C2

InChI

InChI=1S/C19H28N2O3/c1-3-24-19(23)17-10-7-13-21(14-17)18(22)11-12-20-15(2)16-8-5-4-6-9-16/h4-6,8-9,15,17,20H,3,7,10-14H2,1-2H3/p+1/t15-,17-/m0/s1