2-[6-[[3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxidanylidene-propanoyl]amino]naphthalen-1-yl]oxyethanoic acid

Systemtic Name: 2-[6-[[3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxidanylidene-propanoyl]amino]naphthalen-1-yl]oxyethanoic acid Openeye Name: 2-[[6-[[3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxo-propanoyl]amino]-1-naphthyl]oxy]acetic acid CAS Name: 2-[[6-[[3-(4-ethoxycarbonyl-1-piperazinyl)-1,3-dioxopropyl]amino]-1-naphthalenyl]oxy]acetic acid IUPAC Name: 2-[6-[[3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxopropanoyl]amino]naphthalen-1-yl]oxyacetic acid Traditional Name: 2-[6-[[3-(4-carbethoxypiperazino)-3-keto-propanoyl]amino]-1-naphthoxy]acetic acid Formula: C22H25N3O7 MolecularWeight: 443.4498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC(=O)NC2=CC3=C(C=C2)C(=CC=C3)OCC(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC(=O)NC2=CC3=C(C=C2)C(=CC=C3)OCC(=O)O

InChI

InChI=1S/C22H25N3O7/c1-2-31-22(30)25-10-8-24(9-11-25)20(27)13-19(26)23-16-6-7-17-15(12-16)4-3-5-18(17)32-14-21(28)29/h3-7,12H,2,8-11,13-14H2,1H3,(H,23,26)(H,28,29)