methyl 2-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-methyl-amino]benzoate

Systemtic Name: methyl 2-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-methyl-amino]benzoate Openeye Name: methyl 2-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-methyl-amino]benzoate CAS Name: 2-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-methylamino]benzoate Traditional Name: 2-[(9-methoxy-5H-pyrimid[5,4-b]indol-4-yl)-methyl-amino]benzoic acid methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C2=NC=NC3=C2NC4=C3C(=CC=C4)OC

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C2=NC=NC3=C2NC4=C3C(=CC=C4)OC

InChI

InChI=1S/C20H18N4O3/c1-24(14-9-5-4-7-12(14)20(25)27-3)19-18-17(21-11-22-19)16-13(23-18)8-6-10-15(16)26-2/h4-11,23H,1-3H3