4-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]methyl]-6-ethoxy-chromen-2-one

Systemtic Name: 4-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]methyl]-6-ethoxy-chromen-2-one Openeye Name: 6-ethoxy-4-[[4-(2-indolin-1-yl-2-oxo-ethyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 4-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-1-piperazinyl]methyl]-6-ethoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]piperazin-1-yl]methyl]-6-ethoxychromen-2-one Traditional Name: 6-ethoxy-4-[[4-(2-indolin-1-yl-2-keto-ethyl)piperazino]methyl]coumarin Formula: C26H29N3O4 MolecularWeight: 447.52616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C26H29N3O4/c1-2-32-21-7-8-24-22(16-21)20(15-26(31)33-24)17-27-11-13-28(14-12-27)18-25(30)29-10-9-19-5-3-4-6-23(19)29/h3-8,15-16H,2,9-14,17-18H2,1H3