dimethyl 2-[3-[3-[bis(phenylmethyl)amino]propyl]-1H-indol-2-yl]propanedioate

Systemtic Name: dimethyl 2-[3-[3-[bis(phenylmethyl)amino]propyl]-1H-indol-2-yl]propanedioate Openeye Name: dimethyl 2-[3-[3-(dibenzylamino)propyl]-1H-indol-2-yl]propanedioate CAS Name: 2-[3-[3-[bis(phenylmethyl)amino]propyl]-1H-indol-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[3-[3-(dibenzylamino)propyl]-1H-indol-2-yl]propanedioate Traditional Name: 2-[3-[3-(dibenzylamino)propyl]-1H-indol-2-yl]malonic acid dimethyl ester Formula: C30H32N2O4 MolecularWeight: 484.58608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C(C2=CC=CC=C2N1)CCCN(CC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=C(C2=CC=CC=C2N1)CCCN(CC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C30H32N2O4/c1-35-29(33)27(30(34)36-2)28-25(24-16-9-10-18-26(24)31-28)17-11-19-32(20-22-12-5-3-6-13-22)21-23-14-7-4-8-15-23/h3-10,12-16,18,27,31H,11,17,19-21H2,1-2H3