4-[[(2-carboxyphenyl)amino]-methyl-amino]-3,3-dimethyl-indole-5-carboxylic acid

Systemtic Name: 4-[[(2-carboxyphenyl)amino]-methyl-amino]-3,3-dimethyl-indole-5-carboxylic acid Openeye Name: 4-[(2-carboxyanilino)-methyl-amino]-3,3-dimethyl-indole-5-carboxylic acid CAS Name: 4-[(2-carboxyanilino)-methylamino]-3,3-dimethyl-5-indolecarboxylic acid IUPAC Name: 4-[(2-carboxyanilino)-methylamino]-3,3-dimethylindole-5-carboxylic acid Traditional Name: 4-[(2-carboxyanilino)-methyl-amino]-3,3-dimethyl-indole-5-carboxylic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=NC2=C1C(=C(C=C2)C(=O)O)N(C)NC3=CC=CC=C3C(=O)O)C

Isomeric SMILES

CC1(C=NC2=C1C(=C(C=C2)C(=O)O)N(C)NC3=CC=CC=C3C(=O)O)C

InChI

InChI=1S/C19H19N3O4/c1-19(2)10-20-14-9-8-12(18(25)26)16(15(14)19)22(3)21-13-7-5-4-6-11(13)17(23)24/h4-10,21H,1-3H3,(H,23,24)(H,25,26)