methyl 3-[2-[2-[bis(phenylmethyl)amino]ethyl]-1H-indol-3-yl]-2-cyano-propanoate

Systemtic Name: methyl 3-[2-[2-[bis(phenylmethyl)amino]ethyl]-1H-indol-3-yl]-2-cyano-propanoate Openeye Name: methyl 2-cyano-3-[2-[2-(dibenzylamino)ethyl]-1H-indol-3-yl]propanoate CAS Name: 3-[2-[2-[bis(phenylmethyl)amino]ethyl]-1H-indol-3-yl]-2-cyanopropanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-[2-[2-(dibenzylamino)ethyl]-1H-indol-3-yl]propanoate Traditional Name: 2-cyano-3-[2-[2-(dibenzylamino)ethyl]-1H-indol-3-yl]propionic acid methyl ester Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=C(NC2=CC=CC=C21)CCN(CC3=CC=CC=C3)CC4=CC=CC=C4)C#N

Isomeric SMILES

COC(=O)C(CC1=C(NC2=CC=CC=C21)CCN(CC3=CC=CC=C3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C29H29N3O2/c1-34-29(33)24(19-30)18-26-25-14-8-9-15-27(25)31-28(26)16-17-32(20-22-10-4-2-5-11-22)21-23-12-6-3-7-13-23/h2-15,24,31H,16-18,20-21H2,1H3