5-(3-chloranylpropanoylamino)-N-(oxolan-2-ylmethyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-(3-chloranylpropanoylamino)-N-(oxolan-2-ylmethyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(3-chloropropanoylamino)-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 5-[(3-chloro-1-oxopropyl)amino]-N-(2-oxolanylmethyl)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(3-chloropropanoylamino)-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-(3-chloropropanoylamino)-N-(tetrahydrofurfuryl)benzamide Formula: C27H34ClN3O3 MolecularWeight: 484.03016

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)CCCl)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)CCCl)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H34ClN3O3/c28-13-10-26(32)30-22-8-9-25(24(18-22)27(33)29-19-23-7-4-16-34-23)31-14-11-21(12-15-31)17-20-5-2-1-3-6-20/h1-3,5-6,8-9,18,21,23H,4,7,10-17,19H2,(H,29,33)(H,30,32)