2-(methylamino)-7-[(E)-3-(3-nitrophenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-(methylamino)-7-[(E)-3-(3-nitrophenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-(methylamino)-7-[(E)-3-(3-nitrophenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-(methylamino)-7-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-(methylamino)-7-[(E)-3-(3-nitrophenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-(methylamino)-7-[(E)-3-(3-nitrophenyl)acryloyl]cyclohepta-2,4,6-trien-1-one Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC=C(C1=O)C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=CC=CC=C(C1=O)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4/c1-18-15-8-3-2-7-14(17(15)21)16(20)10-9-12-5-4-6-13(11-12)19(22)23/h2-11H,1H3,(H,18,21)/b10-9+