2-(4-ethylpiperazin-1-yl)-5-[(4-methoxyphenyl)carbonylamino]benzoic acid

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-5-[(4-methoxyphenyl)carbonylamino]benzoic acid Openeye Name: 2-(4-ethylpiperazin-1-yl)-5-[(4-methoxybenzoyl)amino]benzoic acid CAS Name: 2-(4-ethyl-1-piperazinyl)-5-[[(4-methoxyphenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 2-(4-ethylpiperazin-1-yl)-5-[(4-methoxybenzoyl)amino]benzoic acid Traditional Name: 2-(4-ethylpiperazino)-5-(p-anisoylamino)benzoic acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C(=O)O

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C21H25N3O4/c1-3-23-10-12-24(13-11-23)19-9-6-16(14-18(19)21(26)27)22-20(25)15-4-7-17(28-2)8-5-15/h4-9,14H,3,10-13H2,1-2H3,(H,22,25)(H,26,27)