4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide

Systemtic Name: 4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Openeye Name: 4-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 4-[(2,5-dioxo-1-pyrrolidinyl)methyl]-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: 4-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Traditional Name: N-(5-piperidino-8-isoquinolyl)-4-(succinimidomethyl)benzamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC=C(C=C4)CN5C(=O)CCC5=O

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC=C(C=C4)CN5C(=O)CCC5=O

InChI

InChI=1S/C26H26N4O3/c31-24-10-11-25(32)30(24)17-18-4-6-19(7-5-18)26(33)28-22-8-9-23(29-14-2-1-3-15-29)20-12-13-27-16-21(20)22/h4-9,12-13,16H,1-3,10-11,14-15,17H2,(H,28,33)