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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC(=O)NC2=CC3=CC=CC=C3C(=C2)OCC(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC(=O)NC2=CC3=CC=CC=C3C(=C2)OCC(=O)O

InChI

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