2-[1,3-benzoxazol-2-yl(methyl)amino]-3-ethoxy-3-phenyl-2-(3-phenylpyrrol-1-yl)propanoic acid

Systemtic Name: 2-[1,3-benzoxazol-2-yl(methyl)amino]-3-ethoxy-3-phenyl-2-(3-phenylpyrrol-1-yl)propanoic acid Openeye Name: 2-[1,3-benzoxazol-2-yl(methyl)amino]-3-ethoxy-3-phenyl-2-(3-phenylpyrrol-1-yl)propanoic acid CAS Name: 2-[1,3-benzoxazol-2-yl(methyl)amino]-3-ethoxy-3-phenyl-2-(3-phenyl-1-pyrrolyl)propanoic acid IUPAC Name: 2-[1,3-benzoxazol-2-yl(methyl)amino]-3-ethoxy-3-phenyl-2-(3-phenylpyrrol-1-yl)propanoic acid Traditional Name: 2-[1,3-benzoxazol-2-yl(methyl)amino]-3-ethoxy-3-phenyl-2-(3-phenylpyrrol-1-yl)propionic acid Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC=CC=C1)C(C(=O)O)(N2C=CC(=C2)C3=CC=CC=C3)N(C)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CCOC(C1=CC=CC=C1)C(C(=O)O)(N2C=CC(=C2)C3=CC=CC=C3)N(C)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C29H27N3O4/c1-3-35-26(22-14-8-5-9-15-22)29(27(33)34,31(2)28-30-24-16-10-11-17-25(24)36-28)32-19-18-23(20-32)21-12-6-4-7-13-21/h4-20,26H,3H2,1-2H3,(H,33,34)