2-(4-azanyl-3,5-diethyl-2-oxidanyl-phenyl)carbonylbenzoic acid

Systemtic Name: 2-(4-azanyl-3,5-diethyl-2-oxidanyl-phenyl)carbonylbenzoic acid Openeye Name: 2-(4-amino-3,5-diethyl-2-hydroxy-benzoyl)benzoic acid CAS Name: 2-[(4-amino-3,5-diethyl-2-hydroxyphenyl)-oxomethyl]benzoic acid IUPAC Name: 2-(4-amino-3,5-diethyl-2-hydroxybenzoyl)benzoic acid Traditional Name: 2-(4-amino-3,5-diethyl-2-hydroxy-benzoyl)benzoic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C(=O)C2=CC=CC=C2C(=O)O)O)CC)N

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C(=O)C2=CC=CC=C2C(=O)O)O)CC)N

InChI

InChI=1S/C18H19NO4/c1-3-10-9-14(16(20)11(4-2)15(10)19)17(21)12-7-5-6-8-13(12)18(22)23/h5-9,20H,3-4,19H2,1-2H3,(H,22,23)