3-[(4-methoxypyridin-2-yl)amino]propyl 2-(3-oxidanylidene-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoate

Systemtic Name: 3-[(4-methoxypyridin-2-yl)amino]propyl 2-(3-oxidanylidene-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoate Openeye Name: 3-[(4-methoxy-2-pyridyl)amino]propyl 2-(3-oxo-1,2,4,5-tetrahydro-2-benzazepin-4-yl)peroxyacetate CAS Name: 2-(3-oxo-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoic acid 3-[(4-methoxy-2-pyridinyl)amino]propyl ester IUPAC Name: 3-[(4-methoxypyridin-2-yl)amino]propyl 2-(3-oxo-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoate Traditional Name: 2-(3-keto-1,2,4,5-tetrahydro-2-benzazepin-4-yl)peracetic acid 3-[(4-methoxy-2-pyridyl)amino]propyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)NCCCOOC(=O)CC2CC3=CC=CC=C3CNC2=O

Isomeric SMILES

COC1=CC(=NC=C1)NCCCOOC(=O)CC2CC3=CC=CC=C3CNC2=O

InChI

InChI=1S/C21H25N3O5/c1-27-18-7-9-23-19(13-18)22-8-4-10-28-29-20(25)12-17-11-15-5-2-3-6-16(15)14-24-21(17)26/h2-3,5-7,9,13,17H,4,8,10-12,14H2,1H3,(H,22,23)(H,24,26)