N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide Openeye Name: 1-(benzylcarbamoylamino)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)cyclopentanecarboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-cyclopentanecarboxamide IUPAC Name: 1-(benzylcarbamoylamino)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)cyclopentane-1-carboxamide Traditional Name: 1-(benzylcarbamoylamino)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)cyclopentanecarboxamide Formula: C22H24BrN3O4 MolecularWeight: 474.34766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NC2=CC3=C(C=C2Br)OCCO3)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C(=O)NC2=CC3=C(C=C2Br)OCCO3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H24BrN3O4/c23-16-12-18-19(30-11-10-29-18)13-17(16)25-20(27)22(8-4-5-9-22)26-21(28)24-14-15-6-2-1-3-7-15/h1-3,6-7,12-13H,4-5,8-11,14H2,(H,25,27)(H2,24,26,28)