(2S)-2-[5-(3-methoxyphenyl)-1,2,3,4-tetrazol-2-yl]-2-phenyl-1-piperidin-1-yl-ethanone

Systemtic Name: (2S)-2-[5-(3-methoxyphenyl)-1,2,3,4-tetrazol-2-yl]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2S)-2-[5-(3-methoxyphenyl)tetrazol-2-yl]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2S)-2-[5-(3-methoxyphenyl)-2-tetrazolyl]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2S)-2-[5-(3-methoxyphenyl)tetrazol-2-yl]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2S)-2-[5-(3-methoxyphenyl)tetrazol-2-yl]-2-phenyl-1-piperidino-ethanone Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(N=N2)C(C3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(N=N2)[C@@H](C3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C21H23N5O2/c1-28-18-12-8-11-17(15-18)20-22-24-26(23-20)19(16-9-4-2-5-10-16)21(27)25-13-6-3-7-14-25/h2,4-5,8-12,15,19H,3,6-7,13-14H2,1H3/t19-/m0/s1