2-[[4-(4,4-diphenylpentyl)-2,3-dihydro-1,4-benzoxazin-8-yl]oxy]ethanoic acid

Systemtic Name: 2-[[4-(4,4-diphenylpentyl)-2,3-dihydro-1,4-benzoxazin-8-yl]oxy]ethanoic acid Openeye Name: 2-[[4-(4,4-diphenylpentyl)-2,3-dihydro-1,4-benzoxazin-8-yl]oxy]acetic acid CAS Name: 2-[[4-(4,4-diphenylpentyl)-2,3-dihydro-1,4-benzoxazin-8-yl]oxy]acetic acid IUPAC Name: 2-[[4-(4,4-diphenylpentyl)-2,3-dihydro-1,4-benzoxazin-8-yl]oxy]acetic acid Traditional Name: 2-[[4-(4,4-diphenylpentyl)-2,3-dihydro-1,4-benzoxazin-8-yl]oxy]acetic acid Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN1CCOC2=C1C=CC=C2OCC(=O)O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CCCN1CCOC2=C1C=CC=C2OCC(=O)O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO4/c1-27(21-10-4-2-5-11-21,22-12-6-3-7-13-22)16-9-17-28-18-19-31-26-23(28)14-8-15-24(26)32-20-25(29)30/h2-8,10-15H,9,16-20H2,1H3,(H,29,30)