2-(2-dimethylaminoethyl)-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one

Systemtic Name: 2-(2-dimethylaminoethyl)-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one Openeye Name: 2-(2-dimethylaminoethyl)-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one CAS Name: 2-(2-dimethylaminoethyl)-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one IUPAC Name: 2-(2-dimethylaminoethyl)-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one Traditional Name: 2-(2-dimethylaminoethyl)-4-(4-nitrobenzyl)-2,3-dihydro-1,4-benzoxazepin-5-one Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1CN(C(=O)C2=CC=CC=C2O1)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCC1CN(C(=O)C2=CC=CC=C2O1)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4/c1-21(2)12-11-17-14-22(13-15-7-9-16(10-8-15)23(25)26)20(24)18-5-3-4-6-19(18)27-17/h3-10,17H,11-14H2,1-2H3