6-methyl-3-[(E)-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]prop-2-enoyl]-2-oxidanyl-pyran-4-one

Systemtic Name: 6-methyl-3-[(E)-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]prop-2-enoyl]-2-oxidanyl-pyran-4-one Openeye Name: 2-hydroxy-6-methyl-3-[(E)-3-[4-(N-methylanilino)-3-nitro-phenyl]prop-2-enoyl]pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-[(E)-3-[4-(N-methylanilino)-3-nitrophenyl]-1-oxoprop-2-enyl]-4-pyranone IUPAC Name: 2-hydroxy-6-methyl-3-[(E)-3-[4-(N-methylanilino)-3-nitrophenyl]prop-2-enoyl]pyran-4-one Traditional Name: 2-hydroxy-6-methyl-3-[(E)-3-[4-(N-methylanilino)-3-nitro-phenyl]acryloyl]pyran-4-one Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC(=C(C=C2)N(C)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=C(C=C2)N(C)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O6/c1-14-12-20(26)21(22(27)30-14)19(25)11-9-15-8-10-17(18(13-15)24(28)29)23(2)16-6-4-3-5-7-16/h3-13,27H,1-2H3/b11-9+