3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoic acid; 1,2,3,4-tetrahydroacridin-9-amine

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoic acid; 1,2,3,4-tetrahydroacridin-9-amine Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoic acid; 1,2,3,4-tetrahydroacridin-9-amine CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid; 1,2,3,4-tetrahydroacridin-9-amine IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid; 1,2,3,4-tetrahydroacridin-9-amine Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid; 1,2,3,4-tetrahydroacridin-9-ylamine Formula: C30H40N2O3 MolecularWeight: 476.6502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)O.C1CCC2=NC3=CC=CC=C3C(=C2C1)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)O.C1CCC2=NC3=CC=CC=C3C(=C2C1)N

InChI

InChI=1S/C17H26O3.C13H14N2/c1-16(2,3)12-9-11(7-8-14(18)19)10-13(15(12)20)17(4,5)6;14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h9-10,20H,7-8H2,1-6H3,(H,18,19);1,3,5,7H,2,4,6,8H2,(H2,14,15)