3-[[1-(2-methoxyethanoyl)-4-(3-methoxyphenyl)carbonyl-piperazin-2-yl]carbonylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[[1-(2-methoxyethanoyl)-4-(3-methoxyphenyl)carbonyl-piperazin-2-yl]carbonylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[[1-(2-methoxyacetyl)-4-(3-methoxybenzoyl)piperazine-2-carbonyl]amino]-3-(2-thienyl)propanoic acid CAS Name: 3-[[[1-(2-methoxy-1-oxoethyl)-4-[(3-methoxyphenyl)-oxomethyl]-2-piperazinyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[[1-(2-methoxyacetyl)-4-(3-methoxybenzoyl)piperazine-2-carbonyl]amino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[[4-m-anisoyl-1-(2-methoxyacetyl)piperazine-2-carbonyl]amino]-3-(2-thienyl)propionic acid Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCN(CC1C(=O)NC(CC(=O)O)C2=CC=CS2)C(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

COCC(=O)N1CCN(CC1C(=O)NC(CC(=O)O)C2=CC=CS2)C(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H27N3O7S/c1-32-14-20(27)26-9-8-25(23(31)15-5-3-6-16(11-15)33-2)13-18(26)22(30)24-17(12-21(28)29)19-7-4-10-34-19/h3-7,10-11,17-18H,8-9,12-14H2,1-2H3,(H,24,30)(H,28,29)