(4-nitrophenyl) 3,3-dimethyl-8-oxidanyl-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalene-1-carboxylate

Systemtic Name: (4-nitrophenyl) 3,3-dimethyl-8-oxidanyl-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalene-1-carboxylate Openeye Name: (4-nitrophenyl) 8-hydroxy-3,3-dimethyl-6-(5-phenylpentoxy)tetralin-1-carboxylate CAS Name: 8-hydroxy-3,3-dimethyl-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalene-1-carboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 8-hydroxy-3,3-dimethyl-6-(5-phenylpentoxy)-2,4-dihydro-1H-naphthalene-1-carboxylate Traditional Name: 8-hydroxy-3,3-dimethyl-6-(5-phenylpentoxy)tetralin-1-carboxylic acid (4-nitrophenyl) ester Formula: C30H33NO6 MolecularWeight: 503.58612

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C=C(C=C2C1)OCCCCCC3=CC=CC=C3)O)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(C2=C(C=C(C=C2C1)OCCCCCC3=CC=CC=C3)O)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C30H33NO6/c1-30(2)19-22-17-25(36-16-8-4-7-11-21-9-5-3-6-10-21)18-27(32)28(22)26(20-30)29(33)37-24-14-12-23(13-15-24)31(34)35/h3,5-6,9-10,12-15,17-18,26,32H,4,7-8,11,16,19-20H2,1-2H3