dimethyl 2-[3-[3-[[(1S)-1-phenylethyl]amino]propyl]-1H-indol-2-yl]propanedioate

Systemtic Name: dimethyl 2-[3-[3-[[(1S)-1-phenylethyl]amino]propyl]-1H-indol-2-yl]propanedioate Openeye Name: dimethyl 2-[3-[3-[[(1S)-1-phenylethyl]amino]propyl]-1H-indol-2-yl]propanedioate CAS Name: 2-[3-[3-[[(1S)-1-phenylethyl]amino]propyl]-1H-indol-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[3-[3-[[(1S)-1-phenylethyl]amino]propyl]-1H-indol-2-yl]propanedioate Traditional Name: 2-[3-[3-[[(1S)-1-phenylethyl]amino]propyl]-1H-indol-2-yl]malonic acid dimethyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCCCC2=C(NC3=CC=CC=C32)C(C(=O)OC)C(=O)OC

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NCCCC2=C(NC3=CC=CC=C32)C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C24H28N2O4/c1-16(17-10-5-4-6-11-17)25-15-9-13-19-18-12-7-8-14-20(18)26-22(19)21(23(27)29-2)24(28)30-3/h4-8,10-12,14,16,21,25-26H,9,13,15H2,1-3H3/t16-/m0/s1