[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitrophenyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitrophenyl]methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone Formula: C23H25N3O6S MolecularWeight: 471.5261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C23H25N3O6S/c1-30-11-12-32-20-14-18(26(28)29)16(13-19(20)31-2)23(27)25-9-7-15(8-10-25)22-24-17-5-3-4-6-21(17)33-22/h3-6,13-15H,7-12H2,1-2H3