propyl 3-[(7-chloranyl-1-benzoxepin-4-yl)carbonylamino]benzoate

Systemtic Name: propyl 3-[(7-chloranyl-1-benzoxepin-4-yl)carbonylamino]benzoate Openeye Name: propyl 3-[(7-chloro-1-benzoxepine-4-carbonyl)amino]benzoate CAS Name: 3-[[(7-chloro-1-benzoxepin-4-yl)-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-[(7-chloro-1-benzoxepine-4-carbonyl)amino]benzoate Traditional Name: 3-[(7-chloro-1-benzoxepin-4-carbonyl)amino]benzoic acid propyl ester Formula: C21H18ClNO4 MolecularWeight: 383.82492

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC=C2

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC=C2

InChI

InChI=1S/C21H18ClNO4/c1-2-9-27-21(25)15-4-3-5-18(13-15)23-20(24)14-8-10-26-19-7-6-17(22)12-16(19)11-14/h3-8,10-13H,2,9H2,1H3,(H,23,24)