[1-(3-chloranyl-4-fluoranyl-phenyl)piperidin-4-yl]-(4-propan-2-yl-1,4-diazepan-1-yl)methanone

Systemtic Name: [1-(3-chloranyl-4-fluoranyl-phenyl)piperidin-4-yl]-(4-propan-2-yl-1,4-diazepan-1-yl)methanone Openeye Name: [1-(3-chloro-4-fluoro-phenyl)-4-piperidyl]-(4-isopropyl-1,4-diazepan-1-yl)methanone CAS Name: [1-(3-chloro-4-fluorophenyl)-4-piperidinyl]-(4-propan-2-yl-1,4-diazepan-1-yl)methanone IUPAC Name: [1-(3-chloro-4-fluorophenyl)piperidin-4-yl]-(4-propan-2-yl-1,4-diazepan-1-yl)methanone Traditional Name: [1-(3-chloro-4-fluoro-phenyl)-4-piperidyl]-(4-isopropyl-1,4-diazepan-1-yl)methanone Formula: C20H29ClFN3O MolecularWeight: 381.915163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCCN(CC1)C(=O)C2CCN(CC2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C)N1CCCN(CC1)C(=O)C2CCN(CC2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H29ClFN3O/c1-15(2)23-8-3-9-25(13-12-23)20(26)16-6-10-24(11-7-16)17-4-5-19(22)18(21)14-17/h4-5,14-16H,3,6-13H2,1-2H3