4-azanylbenzoic acid; 2-ethylhexyl 4-(dimethylamino)benzoate

Systemtic Name: 4-azanylbenzoic acid; 2-ethylhexyl 4-(dimethylamino)benzoate Openeye Name: 4-aminobenzoic acid; 2-ethylhexyl 4-(dimethylamino)benzoate CAS Name: 4-aminobenzoic acid; 4-(dimethylamino)benzoic acid 2-ethylhexyl ester IUPAC Name: 4-aminobenzoic acid; 2-ethylhexyl 4-(dimethylamino)benzoate Traditional Name: 4-aminobenzoic acid; 4-(dimethylamino)benzoic acid 2-ethylhexyl ester Formula: C24H34N2O4 MolecularWeight: 414.53776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC=C(C=C1)N(C)C.C1=CC(=CC=C1C(=O)O)N

Isomeric SMILES

CCCCC(CC)COC(=O)C1=CC=C(C=C1)N(C)C.C1=CC(=CC=C1C(=O)O)N

InChI

InChI=1S/C17H27NO2.C7H7NO2/c1-5-7-8-14(6-2)13-20-17(19)15-9-11-16(12-10-15)18(3)4;8-6-3-1-5(2-4-6)7(9)10/h9-12,14H,5-8,13H2,1-4H3;1-4H,8H2,(H,9,10)