2-[1-[(1R)-1-(3-nitrophenyl)ethyl]piperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-[(1R)-1-(3-nitrophenyl)ethyl]piperidin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-[(1R)-1-(3-nitrophenyl)ethyl]-4-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-[(1R)-1-(3-nitrophenyl)ethyl]-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-[(1R)-1-(3-nitrophenyl)ethyl]piperidin-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-[(1R)-1-(3-nitrophenyl)ethyl]-4-piperidyl]-1,3-benzothiazole Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S/c1-14(16-5-4-6-17(13-16)23(24)25)22-11-9-15(10-12-22)20-21-18-7-2-3-8-19(18)26-20/h2-8,13-15H,9-12H2,1H3/t14-/m1/s1