N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(phenylcarbamoylamino)propanamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(phenylcarbamoylamino)propanamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(phenylcarbamoylamino)propanamide CAS Name: 3-[[anilino(oxo)methyl]amino]-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)propanamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(phenylcarbamoylamino)propanamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(phenylcarbamoylamino)propionamide Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3O4/c20-14-11-16-17(27-10-4-9-26-16)12-15(14)23-18(24)7-8-21-19(25)22-13-5-2-1-3-6-13/h1-3,5-6,11-12H,4,7-10H2,(H,23,24)(H2,21,22,25)