1-[(3-cyanophenyl)methyl]-4-phenylmethoxy-indole-2-carboxylic acid

Systemtic Name: 1-[(3-cyanophenyl)methyl]-4-phenylmethoxy-indole-2-carboxylic acid Openeye Name: 4-benzyloxy-1-[(3-cyanophenyl)methyl]indole-2-carboxylic acid CAS Name: 1-[(3-cyanophenyl)methyl]-4-phenylmethoxy-2-indolecarboxylic acid IUPAC Name: 1-[(3-cyanophenyl)methyl]-4-phenylmethoxyindole-2-carboxylic acid Traditional Name: 4-benzoxy-1-(3-cyanobenzyl)indole-2-carboxylic acid Formula: C24H18N2O3 MolecularWeight: 382.41132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC3=C2C=C(N3CC4=CC=CC(=C4)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC3=C2C=C(N3CC4=CC=CC(=C4)C#N)C(=O)O

InChI

InChI=1S/C24H18N2O3/c25-14-18-8-4-9-19(12-18)15-26-21-10-5-11-23(20(21)13-22(26)24(27)28)29-16-17-6-2-1-3-7-17/h1-13H,15-16H2,(H,27,28)