6-chloranyl-N-[3-(phenylcarbamoylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[3-(phenylcarbamoylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[3-(phenylcarbamoylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[3-(phenylcarbamoylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[3-(phenylcarbamoylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C23H20ClN3O4 MolecularWeight: 437.8756

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4)Cl)OC1

InChI

InChI=1S/C23H20ClN3O4/c24-19-12-15(13-20-21(19)31-11-5-10-30-20)22(28)25-17-8-4-9-18(14-17)27-23(29)26-16-6-2-1-3-7-16/h1-4,6-9,12-14H,5,10-11H2,(H,25,28)(H2,26,27,29)