3-benzamido-4-[4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]benzoic acid

Systemtic Name: 3-benzamido-4-[4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]benzoic acid Openeye Name: 3-benzamido-4-[4-[2-(3-methoxypropylamino)-2-oxo-ethyl]piperazin-1-yl]benzoic acid CAS Name: 3-benzamido-4-[4-[2-(3-methoxypropylamino)-2-oxoethyl]-1-piperazinyl]benzoic acid IUPAC Name: 3-benzamido-4-[4-[2-(3-methoxypropylamino)-2-oxoethyl]piperazin-1-yl]benzoic acid Traditional Name: 3-benzamido-4-[4-[2-keto-2-(3-methoxypropylamino)ethyl]piperazino]benzoic acid Formula: C24H30N4O5 MolecularWeight: 454.5188

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COCCCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H30N4O5/c1-33-15-5-10-25-22(29)17-27-11-13-28(14-12-27)21-9-8-19(24(31)32)16-20(21)26-23(30)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15,17H2,1H3,(H,25,29)(H,26,30)(H,31,32)