N-ethyl-9-[2-(oxan-2-ylmethyl)-1-oxidanylidene-3-piperazin-1-yl-4-propyl-4H-isoquinolin-3-yl]fluorene-9-carboxamide

Systemtic Name: N-ethyl-9-[2-(oxan-2-ylmethyl)-1-oxidanylidene-3-piperazin-1-yl-4-propyl-4H-isoquinolin-3-yl]fluorene-9-carboxamide Openeye Name: N-ethyl-9-[1-oxo-3-piperazin-1-yl-4-propyl-2-(tetrahydropyran-2-ylmethyl)-4H-isoquinolin-3-yl]fluorene-9-carboxamide CAS Name: N-ethyl-9-[2-(2-oxanylmethyl)-1-oxo-3-(1-piperazinyl)-4-propyl-4H-isoquinolin-3-yl]-9-fluorenecarboxamide IUPAC Name: N-ethyl-9-[2-(oxan-2-ylmethyl)-1-oxo-3-piperazin-1-yl-4-propyl-4H-isoquinolin-3-yl]fluorene-9-carboxamide Traditional Name: N-ethyl-9-[1-keto-3-piperazino-4-propyl-2-(tetrahydropyran-2-ylmethyl)-4H-isoquinolin-3-yl]fluorene-9-carboxamide Formula: C38H46N4O3 MolecularWeight: 606.79684

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=CC=CC=C2C(=O)N(C1(C3(C4=CC=CC=C4C5=CC=CC=C53)C(=O)NCC)N6CCNCC6)CC7CCCCO7

Isomeric SMILES

CCCC1C2=CC=CC=C2C(=O)N(C1(C3(C4=CC=CC=C4C5=CC=CC=C53)C(=O)NCC)N6CCNCC6)CC7CCCCO7

InChI

InChI=1S/C38H46N4O3/c1-3-13-34-30-17-5-6-18-31(30)35(43)42(26-27-14-11-12-25-45-27)38(34,41-23-21-39-22-24-41)37(36(44)40-4-2)32-19-9-7-15-28(32)29-16-8-10-20-33(29)37/h5-10,15-20,27,34,39H,3-4,11-14,21-26H2,1-2H3,(H,40,44)