3-[3-[2-(4-azanyl-3-chloranyl-5-methyl-phenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[3-[2-(4-azanyl-3-chloranyl-5-methyl-phenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[2-(4-amino-3-chloro-5-methyl-phenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[2-(4-amino-3-chloro-5-methylphenyl)ethyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[2-(4-amino-3-chloro-5-methylphenyl)ethyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[2-(4-amino-3-chloro-5-methyl-phenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C25H34ClN3O3 MolecularWeight: 460.00876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CCN(C)CCCN2CCC3=CC(=C(C=C3CC2=O)OC)OC)Cl)N

Isomeric SMILES

CC1=C(C(=CC(=C1)CCN(C)CCCN2CCC3=CC(=C(C=C3CC2=O)OC)OC)Cl)N

InChI

InChI=1S/C25H34ClN3O3/c1-17-12-18(13-21(26)25(17)27)6-10-28(2)8-5-9-29-11-7-19-14-22(31-3)23(32-4)15-20(19)16-24(29)30/h12-15H,5-11,16,27H2,1-4H3