methyl 2-[(3S)-1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S)-1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]ethanoate Openeye Name: methyl 2-[(3S)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-piperidyl]acetate CAS Name: 2-[(3S)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]acetate Traditional Name: 2-[(3S)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-piperidyl]acetic acid methyl ester Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCCN(C1)CC2=CC3=C(C=C2Cl)OCO3

Isomeric SMILES

COC(=O)C[C@@H]1CCCN(C1)CC2=CC3=C(C=C2Cl)OCO3

InChI

InChI=1S/C16H20ClNO4/c1-20-16(19)5-11-3-2-4-18(8-11)9-12-6-14-15(7-13(12)17)22-10-21-14/h6-7,11H,2-5,8-10H2,1H3/t11-/m0/s1