methyl 4-oxidanylidene-4-[2-(5-phenylmethoxy-1H-indol-3-yl)ethylamino]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[2-(5-phenylmethoxy-1H-indol-3-yl)ethylamino]butanoate Openeye Name: methyl 4-[2-(5-benzyloxy-1H-indol-3-yl)ethylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[2-(5-phenylmethoxy-1H-indol-3-yl)ethylamino]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[2-(5-phenylmethoxy-1H-indol-3-yl)ethylamino]butanoate Traditional Name: 4-[2-(5-benzoxy-1H-indol-3-yl)ethylamino]-4-keto-butyric acid methyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NCCC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCC(=O)NCCC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4/c1-27-22(26)10-9-21(25)23-12-11-17-14-24-20-8-7-18(13-19(17)20)28-15-16-5-3-2-4-6-16/h2-8,13-14,24H,9-12,15H2,1H3,(H,23,25)