(phenylmethyl) 4-(5-bromanyl-1,2-benzoxazol-3-yl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(5-bromanyl-1,2-benzoxazol-3-yl)piperazine-1-carboxylate Openeye Name: benzyl 4-(5-bromo-1,2-benzoxazol-3-yl)piperazine-1-carboxylate CAS Name: 4-(5-bromo-1,2-benzoxazol-3-yl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(5-bromo-1,2-benzoxazol-3-yl)piperazine-1-carboxylate Traditional Name: 4-(5-bromoindoxazen-3-yl)piperazine-1-carboxylic acid benzyl ester Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NOC3=C2C=C(C=C3)Br)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NOC3=C2C=C(C=C3)Br)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C19H18BrN3O3/c20-15-6-7-17-16(12-15)18(21-26-17)22-8-10-23(11-9-22)19(24)25-13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2