5-methoxy-2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanoylamino]benzoic acid

Systemtic Name: 5-methoxy-2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanoylamino]benzoic acid Openeye Name: 5-methoxy-2-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]acetyl]amino]benzoic acid CAS Name: 5-methoxy-2-[[2-[4-(4-methoxyphenyl)-1-piperazinyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-methoxy-2-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]acetyl]amino]benzoic acid Traditional Name: 5-methoxy-2-[[2-[4-(4-methoxyphenyl)piperazino]acetyl]amino]benzoic acid Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C21H25N3O5/c1-28-16-5-3-15(4-6-16)24-11-9-23(10-12-24)14-20(25)22-19-8-7-17(29-2)13-18(19)21(26)27/h3-8,13H,9-12,14H2,1-2H3,(H,22,25)(H,26,27)