[4-(5-nitro-2-propan-2-yloxy-phenyl)-3-(phenylcarbonyloxymethyl)cyclopenta-1,3-dien-1-yl]methyl benzoate

Systemtic Name: [4-(5-nitro-2-propan-2-yloxy-phenyl)-3-(phenylcarbonyloxymethyl)cyclopenta-1,3-dien-1-yl]methyl benzoate Openeye Name: [3-(benzoyloxymethyl)-4-(2-isopropoxy-5-nitro-phenyl)cyclopenta-1,3-dien-1-yl]methyl benzoate CAS Name: benzoic acid [3-(benzoyloxymethyl)-4-(5-nitro-2-propan-2-yloxyphenyl)-1-cyclopenta-1,3-dienyl]methyl ester IUPAC Name: [3-(benzoyloxymethyl)-4-(5-nitro-2-propan-2-yloxyphenyl)cyclopenta-1,3-dien-1-yl]methyl benzoate Traditional Name: benzoic acid [3-(benzoyloxymethyl)-4-(2-isopropoxy-5-nitro-phenyl)cyclopenta-1,3-dien-1-yl]methyl ester Formula: C30H27NO7 MolecularWeight: 513.53788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])C2=C(C=C(C2)COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])C2=C(C=C(C2)COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H27NO7/c1-20(2)38-28-14-13-25(31(34)35)17-27(28)26-16-21(18-36-29(32)22-9-5-3-6-10-22)15-24(26)19-37-30(33)23-11-7-4-8-12-23/h3-15,17,20H,16,18-19H2,1-2H3