2-[[3,4-bis(oxidanylidene)-2-propan-2-yloxy-cyclobuten-1-yl]amino]-3-(5-methoxy-2-phenyl-phenyl)propanoic acid

Systemtic Name: 2-[[3,4-bis(oxidanylidene)-2-propan-2-yloxy-cyclobuten-1-yl]amino]-3-(5-methoxy-2-phenyl-phenyl)propanoic acid Openeye Name: 2-[(2-isopropoxy-3,4-dioxo-cyclobuten-1-yl)amino]-3-(5-methoxy-2-phenyl-phenyl)propanoic acid CAS Name: 2-[(3,4-dioxo-2-propan-2-yloxy-1-cyclobutenyl)amino]-3-(5-methoxy-2-phenylphenyl)propanoic acid IUPAC Name: 2-[(3,4-dioxo-2-propan-2-yloxycyclobuten-1-yl)amino]-3-(5-methoxy-2-phenylphenyl)propanoic acid Traditional Name: 2-[(2-isopropoxy-3,4-diketo-cyclobuten-1-yl)amino]-3-(5-methoxy-2-phenyl-phenyl)propionic acid Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=O)C1=O)NC(CC2=C(C=CC(=C2)OC)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)OC1=C(C(=O)C1=O)NC(CC2=C(C=CC(=C2)OC)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H23NO6/c1-13(2)30-22-19(20(25)21(22)26)24-18(23(27)28)12-15-11-16(29-3)9-10-17(15)14-7-5-4-6-8-14/h4-11,13,18,24H,12H2,1-3H3,(H,27,28)