3-acetamido-1-methyl-5-phenylmethoxy-indole-2-carboxylic acid

Systemtic Name: 3-acetamido-1-methyl-5-phenylmethoxy-indole-2-carboxylic acid Openeye Name: 3-acetamido-5-benzyloxy-1-methyl-indole-2-carboxylic acid CAS Name: 3-acetamido-1-methyl-5-phenylmethoxy-2-indolecarboxylic acid IUPAC Name: 3-acetamido-1-methyl-5-phenylmethoxyindole-2-carboxylic acid Traditional Name: 3-acetamido-5-benzoxy-1-methyl-indole-2-carboxylic acid Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C)C(=O)O

InChI

InChI=1S/C19H18N2O4/c1-12(22)20-17-15-10-14(25-11-13-6-4-3-5-7-13)8-9-16(15)21(2)18(17)19(23)24/h3-10H,11H2,1-2H3,(H,20,22)(H,23,24)