N-[4-[2-[3-(7,8-dimethoxy-4-oxidanylidene-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]-2-nitro-phenyl]ethanamide dihydrochloride

Systemtic Name: N-[4-[2-[3-(7,8-dimethoxy-4-oxidanylidene-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]-2-nitro-phenyl]ethanamide dihydrochloride Openeye Name: N-[4-[2-[3-(7,8-dimethoxy-4-oxo-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]-2-nitro-phenyl]acetamide dihydrochloride CAS Name: N-[4-[2-[3-(7,8-dimethoxy-4-oxo-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methylamino]ethyl]-2-nitrophenyl]acetamide dihydrochloride IUPAC Name: N-[4-[2-[3-(7,8-dimethoxy-4-oxo-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methylamino]ethyl]-2-nitrophenyl]acetamide dihydrochloride Traditional Name: N-[4-[2-[3-(4-keto-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]-2-nitro-phenyl]acetamide dihydrochloride Formula: C26H36Cl2N4O6 MolecularWeight: 571.49324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)CCN(C)CCCN2CCC3=CC(=C(C=C3CC2=O)OC)OC)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)CCN(C)CCCN2CCC3=CC(=C(C=C3CC2=O)OC)OC)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C26H34N4O6.2ClH/c1-18(31)27-22-7-6-19(14-23(22)30(33)34)8-12-28(2)10-5-11-29-13-9-20-15-24(35-3)25(36-4)16-21(20)17-26(29)32;;/h6-7,14-16H,5,8-13,17H2,1-4H3,(H,27,31);2*1H