[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-(3-methoxy-2-nitro-phenyl)methanone

Systemtic Name: [4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-(3-methoxy-2-nitro-phenyl)methanone Openeye Name: [4-[4-(3-bromophenyl)thiazol-2-yl]-1-piperidyl]-(3-methoxy-2-nitro-phenyl)methanone CAS Name: [4-[4-(3-bromophenyl)-2-thiazolyl]-1-piperidinyl]-(3-methoxy-2-nitrophenyl)methanone IUPAC Name: [4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-(3-methoxy-2-nitrophenyl)methanone Traditional Name: [4-[4-(3-bromophenyl)thiazol-2-yl]piperidino]-(3-methoxy-2-nitro-phenyl)methanone Formula: C22H20BrN3O4S MolecularWeight: 502.3809

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCC(CC2)C3=NC(=CS3)C4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCC(CC2)C3=NC(=CS3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H20BrN3O4S/c1-30-19-7-3-6-17(20(19)26(28)29)22(27)25-10-8-14(9-11-25)21-24-18(13-31-21)15-4-2-5-16(23)12-15/h2-7,12-14H,8-11H2,1H3