4-[[2-(3-azanylpropoxy)phenyl]carbonylamino]-N-[2-[6-(2-dimethylaminoethylamino)-6-oxidanylidene-hexoxy]-4-methyl-phenyl]-3-methoxy-N-methyl-benzamide dihydrochloride

Systemtic Name: 4-[[2-(3-azanylpropoxy)phenyl]carbonylamino]-N-[2-[6-(2-dimethylaminoethylamino)-6-oxidanylidene-hexoxy]-4-methyl-phenyl]-3-methoxy-N-methyl-benzamide dihydrochloride Openeye Name: 4-[[2-(3-aminopropoxy)benzoyl]amino]-N-[2-[6-(2-dimethylaminoethylamino)-6-oxo-hexoxy]-4-methyl-phenyl]-3-methoxy-N-methyl-benzamide dihydrochloride CAS Name: 4-[[[2-(3-aminopropoxy)phenyl]-oxomethyl]amino]-N-[2-[6-(2-dimethylaminoethylamino)-6-oxohexoxy]-4-methylphenyl]-3-methoxy-N-methylbenzamide dihydrochloride IUPAC Name: 4-[[2-(3-aminopropoxy)benzoyl]amino]-N-[2-[6-(2-dimethylaminoethylamino)-6-oxohexoxy]-4-methylphenyl]-3-methoxy-N-methylbenzamide dihydrochloride Traditional Name: 4-[[2-(3-aminopropoxy)benzoyl]amino]-N-[2-[6-(2-dimethylaminoethylamino)-6-keto-hexoxy]-4-methyl-phenyl]-3-methoxy-N-methyl-benzamide dihydrochloride Formula: C36H51Cl2N5O6 MolecularWeight: 720.72604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3OCCCN)OC)OCCCCCC(=O)NCCN(C)C.Cl.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3OCCCN)OC)OCCCCCC(=O)NCCN(C)C.Cl.Cl

InChI

InChI=1S/C36H49N5O6.2ClH/c1-26-15-18-30(33(24-26)47-22-10-6-7-14-34(42)38-20-21-40(2)3)41(4)36(44)27-16-17-29(32(25-27)45-5)39-35(43)28-12-8-9-13-31(28)46-23-11-19-37;;/h8-9,12-13,15-18,24-25H,6-7,10-11,14,19-23,37H2,1-5H3,(H,38,42)(H,39,43);2*1H