(5-methoxycarbonyl-2-methyl-phenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (5-methoxycarbonyl-2-methyl-phenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: (5-methoxycarbonyl-2-methyl-phenyl)-[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: (5-methoxycarbonyl-2-methylphenyl)-[2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]ammonium IUPAC Name: (5-methoxycarbonyl-2-methylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]azanium Traditional Name: (5-carbomethoxy-2-methyl-phenyl)-[2-keto-2-[(3S)-3-methylpiperidino]ethyl]ammonium Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C[NH2+]C2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O3/c1-12-5-4-8-19(11-12)16(20)10-18-15-9-14(17(21)22-3)7-6-13(15)2/h6-7,9,12,18H,4-5,8,10-11H2,1-3H3/p+1/t12-/m0/s1