ethyl 2-[1-(4-nitrophenyl)carbonyl-2,3-dihydro-1-benzazepin-5-yl]ethanoate

Systemtic Name: ethyl 2-[1-(4-nitrophenyl)carbonyl-2,3-dihydro-1-benzazepin-5-yl]ethanoate Openeye Name: ethyl 2-[1-(4-nitrobenzoyl)-2,3-dihydro-1-benzazepin-5-yl]acetate CAS Name: 2-[1-[(4-nitrophenyl)-oxomethyl]-2,3-dihydro-1-benzazepin-5-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(4-nitrobenzoyl)-2,3-dihydro-1-benzazepin-5-yl]acetate Traditional Name: 2-[1-(4-nitrobenzoyl)-2,3-dihydro-1-benzazepin-5-yl]acetic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CCCN(C2=CC=CC=C12)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=CCCN(C2=CC=CC=C12)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-2-28-20(24)14-16-6-5-13-22(19-8-4-3-7-18(16)19)21(25)15-9-11-17(12-10-15)23(26)27/h3-4,6-12H,2,5,13-14H2,1H3