4-chloranyl-N-(furan-2-ylmethyl)-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-(furan-2-ylmethyl)-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: 4-chloro-N-(2-furylmethyl)-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: 4-chloro-N-(2-furanylmethyl)-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: 4-chloro-N-(furan-2-ylmethyl)-3-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: 4-chloro-N-(2-furfuryl)-3-[(3S)-3-methylpiperidino]sulfonyl-benzamide Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)Cl

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)Cl

InChI

InChI=1S/C18H21ClN2O4S/c1-13-4-2-8-21(12-13)26(23,24)17-10-14(6-7-16(17)19)18(22)20-11-15-5-3-9-25-15/h3,5-7,9-10,13H,2,4,8,11-12H2,1H3,(H,20,22)/t13-/m0/s1