ethyl 3-[3-(1H-indol-2-ylcarbonylamino)-6-methoxy-2-oxidanylidene-1-pentyl-indol-3-yl]propanoate

Systemtic Name: ethyl 3-[3-(1H-indol-2-ylcarbonylamino)-6-methoxy-2-oxidanylidene-1-pentyl-indol-3-yl]propanoate Openeye Name: ethyl 3-[3-(1H-indole-2-carbonylamino)-6-methoxy-2-oxo-1-pentyl-indolin-3-yl]propanoate CAS Name: 3-[3-[[1H-indol-2-yl(oxo)methyl]amino]-6-methoxy-2-oxo-1-pentyl-3-indolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(1H-indole-2-carbonylamino)-6-methoxy-2-oxo-1-pentylindol-3-yl]propanoate Traditional Name: 3-[1-amyl-3-(1H-indole-2-carbonylamino)-2-keto-6-methoxy-indolin-3-yl]propionic acid ethyl ester Formula: C28H33N3O5 MolecularWeight: 491.57872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=CC(=C2)OC)C(C1=O)(CCC(=O)OCC)NC(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCCCCN1C2=C(C=CC(=C2)OC)C(C1=O)(CCC(=O)OCC)NC(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C28H33N3O5/c1-4-6-9-16-31-24-18-20(35-3)12-13-21(24)28(27(31)34,15-14-25(32)36-5-2)30-26(33)23-17-19-10-7-8-11-22(19)29-23/h7-8,10-13,17-18,29H,4-6,9,14-16H2,1-3H3,(H,30,33)