[7-methyl-2-(2-morpholin-4-ylethyl)-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isoquinolin-7-yl] cyclopentanecarboxylate

Systemtic Name: [7-methyl-2-(2-morpholin-4-ylethyl)-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isoquinolin-7-yl] cyclopentanecarboxylate Openeye Name: [7-methyl-2-(2-morpholinoethyl)-6,8-dioxo-3-(3-thienyl)-7-isoquinolyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [7-methyl-2-[2-(4-morpholinyl)ethyl]-6,8-dioxo-3-(3-thiophenyl)-7-isoquinolinyl] ester IUPAC Name: [7-methyl-2-(2-morpholin-4-ylethyl)-6,8-dioxo-3-thiophen-3-ylisoquinolin-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [6,8-diketo-7-methyl-2-(2-morpholinoethyl)-3-(3-thienyl)-7-isoquinolyl] ester Formula: C26H30N2O5S MolecularWeight: 482.5918

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CCN3CCOCC3)C4=CSC=C4)OC(=O)C5CCCC5

Isomeric SMILES

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CCN3CCOCC3)C4=CSC=C4)OC(=O)C5CCCC5

InChI

InChI=1S/C26H30N2O5S/c1-26(33-25(31)18-4-2-3-5-18)23(29)15-20-14-22(19-6-13-34-17-19)28(16-21(20)24(26)30)8-7-27-9-11-32-12-10-27/h6,13-18H,2-5,7-12H2,1H3