4-[[5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-benzaldehyde

Systemtic Name: 4-[[5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-benzaldehyde Openeye Name: 4-[[5-[(7-methylindan-4-yl)oxymethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-benzaldehyde CAS Name: 4-[[5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-3-nitrobenzaldehyde IUPAC Name: 4-[[5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitrobenzaldehyde Traditional Name: 4-[[5-[(7-methylindan-4-yl)oxymethyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-3-nitro-benzaldehyde Formula: C26H22N4O4S MolecularWeight: 486.54228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCC2=C(C=C1)OCC3=NN=C(N3C4=CC=CC=C4)SC5=C(C=C(C=C5)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C2CCCC2=C(C=C1)OCC3=NN=C(N3C4=CC=CC=C4)SC5=C(C=C(C=C5)C=O)[N+](=O)[O-]

InChI

InChI=1S/C26H22N4O4S/c1-17-10-12-23(21-9-5-8-20(17)21)34-16-25-27-28-26(29(25)19-6-3-2-4-7-19)35-24-13-11-18(15-31)14-22(24)30(32)33/h2-4,6-7,10-15H,5,8-9,16H2,1H3