[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-(5-methyl-2-oxidanyl-phenyl)methanone

Systemtic Name: [(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-(5-methyl-2-oxidanyl-phenyl)methanone Openeye Name: [(3S)-3-(1H-benzimidazol-2-yl)-1-piperidyl]-(2-hydroxy-5-methyl-phenyl)methanone CAS Name: [(3S)-3-(1H-benzimidazol-2-yl)-1-piperidinyl]-(2-hydroxy-5-methylphenyl)methanone IUPAC Name: [(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-(2-hydroxy-5-methylphenyl)methanone Traditional Name: [(3S)-3-(1H-benzimidazol-2-yl)piperidino]-(2-hydroxy-5-methyl-phenyl)methanone Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H21N3O2/c1-13-8-9-18(24)15(11-13)20(25)23-10-4-5-14(12-23)19-21-16-6-2-3-7-17(16)22-19/h2-3,6-9,11,14,24H,4-5,10,12H2,1H3,(H,21,22)/t14-/m0/s1