methyl 2-[3-[[3-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]methyl]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[[3-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]methyl]indol-1-yl]ethanoate Openeye Name: methyl 2-[3-[[3-(1,3-benzodioxol-5-ylamino)-1-piperidyl]methyl]indol-1-yl]acetate CAS Name: 2-[3-[[3-(1,3-benzodioxol-5-ylamino)-1-piperidinyl]methyl]-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[[3-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]methyl]indol-1-yl]acetate Traditional Name: 2-[3-[[3-(1,3-benzodioxol-5-ylamino)piperidino]methyl]indol-1-yl]acetic acid methyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=C(C2=CC=CC=C21)CN3CCCC(C3)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC(=O)CN1C=C(C2=CC=CC=C21)CN3CCCC(C3)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N3O4/c1-29-24(28)15-27-13-17(20-6-2-3-7-21(20)27)12-26-10-4-5-19(14-26)25-18-8-9-22-23(11-18)31-16-30-22/h2-3,6-9,11,13,19,25H,4-5,10,12,14-16H2,1H3