2-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-4-fluoranyl-aniline

Systemtic Name: 2-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-4-fluoranyl-aniline Openeye Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-4-fluoro-aniline CAS Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-4-fluoroaniline IUPAC Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-4-fluoroaniline Traditional Name: (2-chloro-4-fluoro-phenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)amine Formula: C16H15ClFNO2 MolecularWeight: 307.747203

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H15ClFNO2/c17-13-9-12(18)5-6-14(13)19-10-11-3-1-4-15-16(11)21-8-2-7-20-15/h1,3-6,9,19H,2,7-8,10H2