tert-butyl 2-[7-[(4-cyanophenyl)methoxy]-1-oxidanylidene-4,5-dihydro-3H-2-benzazepin-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[7-[(4-cyanophenyl)methoxy]-1-oxidanylidene-4,5-dihydro-3H-2-benzazepin-2-yl]ethanoate Openeye Name: tert-butyl 2-[7-[(4-cyanophenyl)methoxy]-1-oxo-4,5-dihydro-3H-2-benzazepin-2-yl]acetate CAS Name: 2-[7-[(4-cyanophenyl)methoxy]-1-oxo-4,5-dihydro-3H-2-benzazepin-2-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[7-[(4-cyanophenyl)methoxy]-1-oxo-4,5-dihydro-3H-2-benzazepin-2-yl]acetate Traditional Name: 2-[7-(4-cyanobenzyl)oxy-1-keto-4,5-dihydro-3H-2-benzazepin-2-yl]acetic acid tert-butyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCCC2=C(C1=O)C=CC(=C2)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCCC2=C(C1=O)C=CC(=C2)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H26N2O4/c1-24(2,3)30-22(27)15-26-12-4-5-19-13-20(10-11-21(19)23(26)28)29-16-18-8-6-17(14-25)7-9-18/h6-11,13H,4-5,12,15-16H2,1-3H3