5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazin-1-yl]-1-benzofuran-2-carboxamide; propan-2-one; hydrochloride

Systemtic Name: 5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazin-1-yl]-1-benzofuran-2-carboxamide; propan-2-one; hydrochloride Openeye Name: acetone; 5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazin-1-yl]benzofuran-2-carboxamide; hydrochloride CAS Name: 5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]-1-piperazinyl]-2-benzofurancarboxamide; 2-propanone; hydrochloride IUPAC Name: 5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazin-1-yl]-1-benzofuran-2-carboxamide; propan-2-one; hydrochloride Traditional Name: acetone; 5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazino]coumarilamide; hydrochloride Formula: C29H34ClN5O3 MolecularWeight: 536.06496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=CC5=C(C=C4)OC(=C5)C(=O)N.Cl

Isomeric SMILES

CC(=O)C.C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=CC5=C(C=C4)OC(=C5)C(=O)N.Cl

InChI

InChI=1S/C26H27N5O2.C3H6O.ClH/c27-16-18-4-6-23-22(13-18)19(17-29-23)3-1-2-8-30-9-11-31(12-10-30)21-5-7-24-20(14-21)15-25(33-24)26(28)32;1-3(2)4;/h4-7,13-15,17,29H,1-3,8-12H2,(H2,28,32);1-2H3;1H