methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,1'-cyclopropane]-3-carboxylate

Systemtic Name: methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,1'-cyclopropane]-3-carboxylate Openeye Name: methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,1'-cyclopropane]-3-carboxylate CAS Name: (1S,3R)-1-(1,3-benzodioxol-5-yl)-3-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,1'-cyclopropane]carboxylic acid methyl ester IUPAC Name: methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,1'-cyclopropane]-3-carboxylate Traditional Name: (1S,3R)-1-(1,3-benzodioxol-5-yl)spiro[1,2,3,9-tetrahydro-$b-carboline-4,1'-cyclopropane]-3-carboxylic acid methyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2(CC2)C3=C(C(N1)C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C63

Isomeric SMILES

COC(=O)[C@H]1C2(CC2)C3=C([C@@H](N1)C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C63

InChI

InChI=1S/C22H20N2O4/c1-26-21(25)20-22(8-9-22)17-13-4-2-3-5-14(13)23-19(17)18(24-20)12-6-7-15-16(10-12)28-11-27-15/h2-7,10,18,20,23-24H,8-9,11H2,1H3/t18-,20-/m0/s1