2-(4-ethoxycarbonylpiperazin-1-yl)carbonyl-4-(naphthalen-2-ylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(4-ethoxycarbonylpiperazin-1-yl)carbonyl-4-(naphthalen-2-ylamino)-4-oxidanylidene-butanoic acid Openeye Name: 2-(4-ethoxycarbonylpiperazine-1-carbonyl)-4-(2-naphthylamino)-4-oxo-butanoic acid CAS Name: 2-[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]-4-(2-naphthalenylamino)-4-oxobutanoic acid IUPAC Name: 2-(4-ethoxycarbonylpiperazine-1-carbonyl)-4-(naphthalen-2-ylamino)-4-oxobutanoic acid Traditional Name: 2-(4-carbethoxypiperazine-1-carbonyl)-4-keto-4-(2-naphthylamino)butyric acid Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O6/c1-2-31-22(30)25-11-9-24(10-12-25)20(27)18(21(28)29)14-19(26)23-17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13,18H,2,9-12,14H2,1H3,(H,23,26)(H,28,29)