(E)-1-(6-azanyl-1,3-benzodioxol-5-yl)-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(6-azanyl-1,3-benzodioxol-5-yl)-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(6-amino-1,3-benzodioxol-5-yl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(6-amino-1,3-benzodioxol-5-yl)-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(6-amino-1,3-benzodioxol-5-yl)-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(6-amino-1,3-benzodioxol-5-yl)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O5/c17-13-8-16-15(22-9-23-16)7-12(13)14(19)5-4-10-2-1-3-11(6-10)18(20)21/h1-8H,9,17H2/b5-4+