N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-[2-(4-methoxyphenyl)-1-methyl-ethylidene]amino]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-[2-(4-methoxyphenyl)-1-methyl-ethylidene]amino]-3-piperidinosulfonyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)/CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O4S/c1-17(15-18-9-11-20(29-2)12-10-18)23-24-22(26)19-7-6-8-21(16-19)30(27,28)25-13-4-3-5-14-25/h6-12,16H,3-5,13-15H2,1-2H3,(H,24,26)/b23-17+