3-[(3R)-1-(1,3-benzodioxol-4-ylmethyl)piperidin-3-yl]-N-(3-chloranyl-4-methoxy-phenyl)propanamide

Systemtic Name: 3-[(3R)-1-(1,3-benzodioxol-4-ylmethyl)piperidin-3-yl]-N-(3-chloranyl-4-methoxy-phenyl)propanamide Openeye Name: 3-[(3R)-1-(1,3-benzodioxol-4-ylmethyl)-3-piperidyl]-N-(3-chloro-4-methoxy-phenyl)propanamide CAS Name: 3-[(3R)-1-(1,3-benzodioxol-4-ylmethyl)-3-piperidinyl]-N-(3-chloro-4-methoxyphenyl)propanamide IUPAC Name: 3-[(3R)-1-(1,3-benzodioxol-4-ylmethyl)piperidin-3-yl]-N-(3-chloro-4-methoxyphenyl)propanamide Traditional Name: 3-[(3R)-1-(1,3-benzodioxol-4-ylmethyl)-3-piperidyl]-N-(3-chloro-4-methoxy-phenyl)propionamide Formula: C23H27ClN2O4 MolecularWeight: 430.92448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCC2CCCN(C2)CC3=C4C(=CC=C3)OCO4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CC[C@H]2CCCN(C2)CC3=C4C(=CC=C3)OCO4)Cl

InChI

InChI=1S/C23H27ClN2O4/c1-28-20-9-8-18(12-19(20)24)25-22(27)10-7-16-4-3-11-26(13-16)14-17-5-2-6-21-23(17)30-15-29-21/h2,5-6,8-9,12,16H,3-4,7,10-11,13-15H2,1H3,(H,25,27)/t16-/m1/s1