(3,4-dimethoxyphenyl)-[(3S)-1-(3-phenylprop-2-ynyl)piperidin-3-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[(3S)-1-(3-phenylprop-2-ynyl)piperidin-3-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[(3S)-1-(3-phenylprop-2-ynyl)-3-piperidyl]methanone CAS Name: (3,4-dimethoxyphenyl)-[(3S)-1-(3-phenylprop-2-ynyl)-3-piperidinyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[(3S)-1-(3-phenylprop-2-ynyl)piperidin-3-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[(3S)-1-(3-phenylprop-2-ynyl)-3-piperidyl]methanone Formula: C23H25NO3 MolecularWeight: 363.4495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2CCCN(C2)CC#CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[C@H]2CCCN(C2)CC#CC3=CC=CC=C3)OC

InChI

InChI=1S/C23H25NO3/c1-26-21-13-12-19(16-22(21)27-2)23(25)20-11-7-15-24(17-20)14-6-10-18-8-4-3-5-9-18/h3-5,8-9,12-13,16,20H,7,11,14-15,17H2,1-2H3/t20-/m0/s1