2-azanyl-5-[2-[3-(7,8-dimethoxy-4-oxidanylidene-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]benzenecarbonitrile

Systemtic Name: 2-azanyl-5-[2-[3-(7,8-dimethoxy-4-oxidanylidene-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]benzenecarbonitrile Openeye Name: 2-amino-5-[2-[3-(7,8-dimethoxy-4-oxo-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]benzonitrile CAS Name: 2-amino-5-[2-[3-(7,8-dimethoxy-4-oxo-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methylamino]ethyl]benzonitrile IUPAC Name: 2-amino-5-[2-[3-(7,8-dimethoxy-4-oxo-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methylamino]ethyl]benzonitrile Traditional Name: 2-amino-5-[2-[3-(4-keto-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-3-yl)propyl-methyl-amino]ethyl]benzonitrile Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)CCC3=CC(=C(C=C3)N)C#N

Isomeric SMILES

CN(CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)CCC3=CC(=C(C=C3)N)C#N

InChI

InChI=1S/C25H32N4O3/c1-28(11-7-18-5-6-22(27)21(13-18)17-26)9-4-10-29-12-8-19-14-23(31-2)24(32-3)15-20(19)16-25(29)30/h5-6,13-15H,4,7-12,16,27H2,1-3H3