[(3S)-1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-yl]-(3,4-dimethoxyphenyl)methanone

Systemtic Name: [(3S)-1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-yl]-(3,4-dimethoxyphenyl)methanone Openeye Name: [(3S)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-3-piperidyl]-(3,4-dimethoxyphenyl)methanone CAS Name: [(3S)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-3-piperidinyl]-(3,4-dimethoxyphenyl)methanone IUPAC Name: [(3S)-1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-yl]-(3,4-dimethoxyphenyl)methanone Traditional Name: [(3S)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-3-piperidyl]-(3,4-dimethoxyphenyl)methanone Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)CN2CCCC(C2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCC1=NC=C(N1)CN2CCC[C@@H](C2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H31N3O3/c1-4-5-8-21-23-13-18(24-21)15-25-11-6-7-17(14-25)22(26)16-9-10-19(27-2)20(12-16)28-3/h9-10,12-13,17H,4-8,11,14-15H2,1-3H3,(H,23,24)/t17-/m0/s1