3-(1,3-benzodioxol-5-yl)-N-[2-[(2-nitrophenyl)amino]ethyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(2-nitrophenyl)amino]ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-nitroanilino)ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-nitroanilino)ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-nitroanilino)ethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-nitroanilino)ethyl]propionamide Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c22-18(8-6-13-5-7-16-17(11-13)26-12-25-16)20-10-9-19-14-3-1-2-4-15(14)21(23)24/h1-5,7,11,19H,6,8-10,12H2,(H,20,22)