2-methyl-4-[2-(7-nitro-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethoxy]aniline dihydrochloride

Systemtic Name: 2-methyl-4-[2-(7-nitro-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethoxy]aniline dihydrochloride Openeye Name: 2-methyl-4-[2-(7-nitro-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethoxy]aniline dihydrochloride CAS Name: 2-methyl-4-[2-(7-nitro-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethoxy]aniline dihydrochloride IUPAC Name: 2-methyl-4-[2-(7-nitro-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethoxy]aniline dihydrochloride Traditional Name: [2-methyl-4-[2-(7-nitro-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethoxy]phenyl]amine dihydrochloride Formula: C19H25Cl2N3O3 MolecularWeight: 414.3261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCN2CCC3=C(CC2)C=C(C=C3)[N+](=O)[O-])N.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCN2CCC3=C(CC2)C=C(C=C3)[N+](=O)[O-])N.Cl.Cl

InChI

InChI=1S/C19H23N3O3.2ClH/c1-14-12-18(4-5-19(14)20)25-11-10-21-8-6-15-2-3-17(22(23)24)13-16(15)7-9-21;;/h2-5,12-13H,6-11,20H2,1H3;2*1H