4-[(4,4-dimethyl-2,3-dihydrochromen-6-yl)diazenyl]benzoic acid

Systemtic Name: 4-[(4,4-dimethyl-2,3-dihydrochromen-6-yl)diazenyl]benzoic acid Openeye Name: 4-(4,4-dimethylchroman-6-yl)azobenzoic acid CAS Name: 4-[(4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)azo]benzoic acid IUPAC Name: 4-[(4,4-dimethyl-2,3-dihydrochromen-6-yl)diazenyl]benzoic acid Traditional Name: 4-(4,4-dimethylchroman-6-yl)azobenzoic acid Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCOC2=C1C=C(C=C2)N=NC3=CC=C(C=C3)C(=O)O)C

Isomeric SMILES

CC1(CCOC2=C1C=C(C=C2)N=NC3=CC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C18H18N2O3/c1-18(2)9-10-23-16-8-7-14(11-15(16)18)20-19-13-5-3-12(4-6-13)17(21)22/h3-8,11H,9-10H2,1-2H3,(H,21,22)