methyl 3-[2-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoate

Systemtic Name: methyl 3-[2-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoate Openeye Name: methyl 3-[2-[3-(2H-tetrazol-5-yl)benzoyl]-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoate CAS Name: 3-[2-[oxo-[3-(2H-tetrazol-5-yl)phenyl]methyl]-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-(2H-tetrazol-5-yl)benzoyl]-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoate Traditional Name: 3-[2-[3-(2H-tetrazol-5-yl)benzoyl]-1,3,4,9-tetrahydro-$b-carbolin-1-yl]benzoic acid methyl ester Formula: C27H22N6O3 MolecularWeight: 478.50198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C2C3=C(CCN2C(=O)C4=CC=CC(=C4)C5=NNN=N5)C6=CC=CC=C6N3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C2C3=C(CCN2C(=O)C4=CC=CC(=C4)C5=NNN=N5)C6=CC=CC=C6N3

InChI

InChI=1S/C27H22N6O3/c1-36-27(35)19-9-4-6-16(14-19)24-23-21(20-10-2-3-11-22(20)28-23)12-13-33(24)26(34)18-8-5-7-17(15-18)25-29-31-32-30-25/h2-11,14-15,24,28H,12-13H2,1H3,(H,29,30,31,32)