2-(3-acetamidopropoxy)-N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]benzamide hydrochloride

Systemtic Name: 2-(3-acetamidopropoxy)-N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]benzamide hydrochloride Openeye Name: 2-(3-acetamidopropoxy)-N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]carbamoyl]phenyl]benzamide hydrochloride CAS Name: 2-(3-acetamidopropoxy)-N-[4-[[N-methyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]anilino]-oxomethyl]phenyl]benzamide hydrochloride IUPAC Name: 2-(3-acetamidopropoxy)-N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]carbamoyl]phenyl]benzamide hydrochloride Traditional Name: 2-(3-acetamidopropoxy)-N-[4-[[2-[6-keto-6-(4-methylpiperazino)hexoxy]phenyl]-methyl-carbamoyl]phenyl]benzamide hydrochloride Formula: C37H48ClN5O6 MolecularWeight: 694.25992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3OCCCCCC(=O)N4CCN(CC4)C.Cl

Isomeric SMILES

CC(=O)NCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3OCCCCCC(=O)N4CCN(CC4)C.Cl

InChI

InChI=1S/C37H47N5O6.ClH/c1-28(43)38-21-11-27-47-33-14-8-6-12-31(33)36(45)39-30-19-17-29(18-20-30)37(46)41(3)32-13-7-9-15-34(32)48-26-10-4-5-16-35(44)42-24-22-40(2)23-25-42;/h6-9,12-15,17-20H,4-5,10-11,16,21-27H2,1-3H3,(H,38,43)(H,39,45);1H