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

Systemtic Name: 5-(3-chloranylpropanoylamino)-N-(3-ethoxypropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(3-chloropropanoylamino)-N-(3-ethoxypropyl)benzamide CAS Name: 5-[(3-chloro-1-oxopropyl)amino]-N-(3-ethoxypropyl)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(3-chloropropanoylamino)-N-(3-ethoxypropyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-(3-chloropropanoylamino)-N-(3-ethoxypropyl)benzamide Formula: C27H36ClN3O3 MolecularWeight: 486.04604

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)CCCl)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)CCCl)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C27H36ClN3O3/c1-2-34-18-6-15-29-27(33)24-20-23(30-26(32)11-14-28)9-10-25(24)31-16-12-22(13-17-31)19-21-7-4-3-5-8-21/h3-5,7-10,20,22H,2,6,11-19H2,1H3,(H,29,33)(H,30,32)