5-iodanyl-7-nitro-1-(4-phenylmethoxy-3-propan-2-yl-phenoxy)-2,3-dihydro-1H-indene

Systemtic Name: 5-iodanyl-7-nitro-1-(4-phenylmethoxy-3-propan-2-yl-phenoxy)-2,3-dihydro-1H-indene Openeye Name: 1-(4-benzyloxy-3-isopropyl-phenoxy)-5-iodo-7-nitro-indane CAS Name: 5-iodo-7-nitro-1-(4-phenylmethoxy-3-propan-2-ylphenoxy)-2,3-dihydro-1H-indene IUPAC Name: 5-iodo-7-nitro-1-(4-phenylmethoxy-3-propan-2-ylphenoxy)-2,3-dihydro-1H-indene Traditional Name: 1-(4-benzoxy-3-isopropyl-phenoxy)-5-iodo-7-nitro-indane Formula: C25H24INO4 MolecularWeight: 529.36683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2CCC3=CC(=CC(=C23)[N+](=O)[O-])I)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2CCC3=CC(=CC(=C23)[N+](=O)[O-])I)OCC4=CC=CC=C4

InChI

InChI=1S/C25H24INO4/c1-16(2)21-14-20(9-11-23(21)30-15-17-6-4-3-5-7-17)31-24-10-8-18-12-19(26)13-22(25(18)24)27(28)29/h3-7,9,11-14,16,24H,8,10,15H2,1-2H3