1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)urea Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)urea CAS Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-nitrophenyl)urea Traditional Name: 1-homopiperonyl-3-(4-nitrophenyl)urea Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5/c20-16(18-12-2-4-13(5-3-12)19(21)22)17-8-7-11-1-6-14-15(9-11)24-10-23-14/h1-6,9H,7-8,10H2,(H2,17,18,20)