methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-3-[(3-nitrophenyl)methyl]-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-3-[(3-nitrophenyl)methyl]-4-oxidanylidene-but-2-enoate Openeye Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-3-[(3-nitrophenyl)methyl]-4-oxo-but-2-enoate CAS Name: (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-3-[(3-nitrophenyl)methyl]-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-3-[(3-nitrophenyl)methyl]-4-oxobut-2-enoate Traditional Name: (Z)-2-(1,3-benzodioxol-5-yl)-4-keto-4-(4-methoxyphenyl)-3-(3-nitrobenzyl)but-2-enoic acid methyl ester Formula: C26H21NO8 MolecularWeight: 475.44684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=C(C2=CC3=C(C=C2)OCO3)C(=O)OC)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C(/C2=CC3=C(C=C2)OCO3)\C(=O)OC)/CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H21NO8/c1-32-20-9-6-17(7-10-20)25(28)21(13-16-4-3-5-19(12-16)27(30)31)24(26(29)33-2)18-8-11-22-23(14-18)35-15-34-22/h3-12,14H,13,15H2,1-2H3/b24-21-