[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-ethoxy-3-methoxy-phenyl)methanone

Systemtic Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-ethoxy-3-methoxy-phenyl)methanone Openeye Name: [(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(4-ethoxy-3-methoxy-phenyl)methanone CAS Name: [(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(4-ethoxy-3-methoxyphenyl)methanone IUPAC Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-ethoxy-3-methoxyphenyl)methanone Traditional Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-(4-ethoxy-3-methoxy-phenyl)methanone Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C22H24N2O3S/c1-3-27-18-11-10-15(13-19(18)26-2)22(25)24-12-6-7-16(14-24)21-23-17-8-4-5-9-20(17)28-21/h4-5,8-11,13,16H,3,6-7,12,14H2,1-2H3/t16-/m1/s1