4-azanyl-2-[5-azanyl-2-(3-oxidanylpropoxycarbonyl)phenyl]benzoic acid

Systemtic Name: 4-azanyl-2-[5-azanyl-2-(3-oxidanylpropoxycarbonyl)phenyl]benzoic acid Openeye Name: 4-amino-2-[5-amino-2-(3-hydroxypropoxycarbonyl)phenyl]benzoic acid CAS Name: 4-amino-2-[5-amino-2-[3-hydroxypropoxy(oxo)methyl]phenyl]benzoic acid IUPAC Name: 4-amino-2-[5-amino-2-(3-hydroxypropoxycarbonyl)phenyl]benzoic acid Traditional Name: 4-amino-2-[5-amino-2-(3-hydroxypropoxycarbonyl)phenyl]benzoic acid Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C2=C(C=CC(=C2)N)C(=O)OCCCO)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)C2=C(C=CC(=C2)N)C(=O)OCCCO)C(=O)O

InChI

InChI=1S/C17H18N2O5/c18-10-2-4-12(16(21)22)14(8-10)15-9-11(19)3-5-13(15)17(23)24-7-1-6-20/h2-5,8-9,20H,1,6-7,18-19H2,(H,21,22)