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

Systemtic Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-indole-2-carboxylic acid Openeye Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-indole-2-carboxylic acid CAS Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-2-indolecarboxylic acid IUPAC Name: 1-[(3-cyanophenyl)methyl]-4-methoxyindole-2-carboxylic acid Traditional Name: 1-(3-cyanobenzyl)-4-methoxy-indole-2-carboxylic acid Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=C(N2CC3=CC=CC(=C3)C#N)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C=C(N2CC3=CC=CC(=C3)C#N)C(=O)O

InChI

InChI=1S/C18H14N2O3/c1-23-17-7-3-6-15-14(17)9-16(18(21)22)20(15)11-13-5-2-4-12(8-13)10-19/h2-9H,11H2,1H3,(H,21,22)