(4-methoxycarbonylphenyl)methyl-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]azanium

Systemtic Name: (4-methoxycarbonylphenyl)methyl-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]azanium Openeye Name: (4-methoxycarbonylphenyl)methyl-[(1S)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl]ammonium CAS Name: (4-methoxycarbonylphenyl)methyl-[(1S)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]ammonium IUPAC Name: (4-methoxycarbonylphenyl)methyl-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]azanium Traditional Name: (4-carbomethoxybenzyl)-[(1S)-2-keto-1-phenyl-2-piperidino-ethyl]ammonium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C[NH2+]C(C2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C[NH2+][C@@H](C2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C22H26N2O3/c1-27-22(26)19-12-10-17(11-13-19)16-23-20(18-8-4-2-5-9-18)21(25)24-14-6-3-7-15-24/h2,4-5,8-13,20,23H,3,6-7,14-16H2,1H3/p+1/t20-/m0/s1