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

Systemtic Name: 4-(3-iodanyl-4-phenylmethoxy-phenoxy)-5-methyl-7-nitro-2,3-dihydro-1H-indene Openeye Name: 4-(4-benzyloxy-3-iodo-phenoxy)-5-methyl-7-nitro-indane CAS Name: 4-(3-iodo-4-phenylmethoxyphenoxy)-5-methyl-7-nitro-2,3-dihydro-1H-indene IUPAC Name: 4-(3-iodo-4-phenylmethoxyphenoxy)-5-methyl-7-nitro-2,3-dihydro-1H-indene Traditional Name: 4-(4-benzoxy-3-iodo-phenoxy)-5-methyl-7-nitro-indane Formula: C23H20INO4 MolecularWeight: 501.31367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CCCC2=C1OC3=CC(=C(C=C3)OCC4=CC=CC=C4)I)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C2CCCC2=C1OC3=CC(=C(C=C3)OCC4=CC=CC=C4)I)[N+](=O)[O-]

InChI

InChI=1S/C23H20INO4/c1-15-12-21(25(26)27)18-8-5-9-19(18)23(15)29-17-10-11-22(20(24)13-17)28-14-16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9,14H2,1H3