[5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-(2-methyl-4-nitro-phenyl)methanone

Systemtic Name: [5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-(2-methyl-4-nitro-phenyl)methanone Openeye Name: [5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-(2-methyl-4-nitro-phenyl)methanone CAS Name: [5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-(2-methyl-4-nitrophenyl)methanone IUPAC Name: [5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-(2-methyl-4-nitrophenyl)methanone Traditional Name: [5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-(2-methyl-4-nitro-phenyl)methanone Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)N2CCCC(C3=CC=CC=C32)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)N2CCCC(C3=CC=CC=C32)N(C)C

InChI

InChI=1S/C20H23N3O3/c1-14-13-15(23(25)26)10-11-16(14)20(24)22-12-6-9-18(21(2)3)17-7-4-5-8-19(17)22/h4-5,7-8,10-11,13,18H,6,9,12H2,1-3H3