[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone

Systemtic Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-methyl-3-nitrophenyl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)piperidino]-(2-methyl-3-nitro-phenyl)methanone Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O3S/c1-13-15(7-4-9-17(13)23(25)26)20(24)22-11-5-6-14(12-22)19-21-16-8-2-3-10-18(16)27-19/h2-4,7-10,14H,5-6,11-12H2,1H3