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

Systemtic Name: methyl 2-[3-[2-[bis(phenylmethyl)amino]ethyl]-1H-indol-2-yl]-3-oxidanylidene-propanoate Openeye Name: methyl 2-[3-[2-(dibenzylamino)ethyl]-1H-indol-2-yl]-3-oxo-propanoate CAS Name: 2-[3-[2-[bis(phenylmethyl)amino]ethyl]-1H-indol-2-yl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 2-[3-[2-(dibenzylamino)ethyl]-1H-indol-2-yl]-3-oxopropanoate Traditional Name: 2-[3-[2-(dibenzylamino)ethyl]-1H-indol-2-yl]-3-keto-propionic acid methyl ester Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28N2O3/c1-33-28(32)25(20-31)27-24(23-14-8-9-15-26(23)29-27)16-17-30(18-21-10-4-2-5-11-21)19-22-12-6-3-7-13-22/h2-15,20,25,29H,16-19H2,1H3