3-ethoxy-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]-2-[(2-phenylmethoxyphenyl)carbonylamino]benzamide

Systemtic Name: 3-ethoxy-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]-2-[(2-phenylmethoxyphenyl)carbonylamino]benzamide Openeye Name: 2-[(2-benzyloxybenzoyl)amino]-3-ethoxy-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]benzamide CAS Name: 3-ethoxy-N-methyl-N-[4-methyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]phenyl]-2-[[oxo-(2-phenylmethoxyphenyl)methyl]amino]benzamide IUPAC Name: 3-ethoxy-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]-2-[(2-phenylmethoxybenzoyl)amino]benzamide Traditional Name: 2-[(2-benzoxybenzoyl)amino]-3-ethoxy-N-[2-[6-keto-6-(4-methylpiperazino)hexoxy]-4-methyl-phenyl]-N-methyl-benzamide Formula: C42H50N4O6 MolecularWeight: 706.8696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1NC(=O)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)N(C)C4=C(C=C(C=C4)C)OCCCCCC(=O)N5CCN(CC5)C

Isomeric SMILES

CCOC1=CC=CC(=C1NC(=O)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)N(C)C4=C(C=C(C=C4)C)OCCCCCC(=O)N5CCN(CC5)C

InChI

InChI=1S/C42H50N4O6/c1-5-50-37-20-14-18-34(40(37)43-41(48)33-17-11-12-19-36(33)52-30-32-15-8-6-9-16-32)42(49)45(4)35-23-22-31(2)29-38(35)51-28-13-7-10-21-39(47)46-26-24-44(3)25-27-46/h6,8-9,11-12,14-20,22-23,29H,5,7,10,13,21,24-28,30H2,1-4H3,(H,43,48)