2-[(3-methoxycarbonyl-1-adamantyl)carbonylamino]-3-[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]propanoic acid

Systemtic Name: 2-[(3-methoxycarbonyl-1-adamantyl)carbonylamino]-3-[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]propanoic acid Openeye Name: 2-[(3-methoxycarbonyladamantane-1-carbonyl)amino]-3-[3-(2-methoxyphenyl)isoxazol-5-yl]propanoic acid CAS Name: 2-[[(3-methoxycarbonyl-1-adamantyl)-oxomethyl]amino]-3-[3-(2-methoxyphenyl)-5-isoxazolyl]propanoic acid IUPAC Name: 2-[(3-methoxycarbonyladamantane-1-carbonyl)amino]-3-[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]propanoic acid Traditional Name: 2-[(3-carbomethoxyadamantane-1-carbonyl)amino]-3-[3-(2-methoxyphenyl)isoxazol-5-yl]propionic acid Formula: C26H30N2O7 MolecularWeight: 482.5256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)CC(C(=O)O)NC(=O)C34CC5CC(C3)CC(C5)(C4)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)CC(C(=O)O)NC(=O)C34CC5CC(C3)CC(C5)(C4)C(=O)OC

InChI

InChI=1S/C26H30N2O7/c1-33-21-6-4-3-5-18(21)19-8-17(35-28-19)9-20(22(29)30)27-23(31)25-10-15-7-16(11-25)13-26(12-15,14-25)24(32)34-2/h3-6,8,15-16,20H,7,9-14H2,1-2H3,(H,27,31)(H,29,30)