3-(aminocarbonylamino)-3-(4-chlorophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide

Systemtic Name: 3-(aminocarbonylamino)-3-(4-chlorophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide Openeye Name: 3-(4-chlorophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-3-(4-chlorophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide IUPAC Name: 3-(carbamoylamino)-3-(4-chlorophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide Traditional Name: 3-(4-chlorophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ureido-propionamide Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3O4/c20-13-4-2-12(3-5-13)15(23-19(21)25)11-18(24)22-14-6-7-16-17(10-14)27-9-1-8-26-16/h2-7,10,15H,1,8-9,11H2,(H,22,24)(H3,21,23,25)