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

Systemtic Name: 5-iodanyl-7-nitro-4-(4-phenylmethoxy-3-propan-2-yl-phenoxy)-2,3-dihydro-1H-indene Openeye Name: 4-(4-benzyloxy-3-isopropyl-phenoxy)-5-iodo-7-nitro-indane CAS Name: 5-iodo-7-nitro-4-(4-phenylmethoxy-3-propan-2-ylphenoxy)-2,3-dihydro-1H-indene IUPAC Name: 5-iodo-7-nitro-4-(4-phenylmethoxy-3-propan-2-ylphenoxy)-2,3-dihydro-1H-indene Traditional Name: 4-(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)OC2=C(C=C(C3=C2CCC3)[N+](=O)[O-])I)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C3=C2CCC3)[N+](=O)[O-])I)OCC4=CC=CC=C4

InChI

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