3-methanoyl-1-[(2,4,6-trimethylphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-methanoyl-1-[(2,4,6-trimethylphenyl)methyl]indole-2-carboxylic acid Openeye Name: 3-formyl-1-[(2,4,6-trimethylphenyl)methyl]indole-2-carboxylic acid CAS Name: 3-formyl-1-[(2,4,6-trimethylphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-formyl-1-[(2,4,6-trimethylphenyl)methyl]indole-2-carboxylic acid Traditional Name: 3-formyl-1-(2,4,6-trimethylbenzyl)indole-2-carboxylic acid Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CN2C3=CC=CC=C3C(=C2C(=O)O)C=O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CN2C3=CC=CC=C3C(=C2C(=O)O)C=O)C

InChI

InChI=1S/C20H19NO3/c1-12-8-13(2)16(14(3)9-12)10-21-18-7-5-4-6-15(18)17(11-22)19(21)20(23)24/h4-9,11H,10H2,1-3H3,(H,23,24)