1,4-bis(chloranyl)-3-[3-(phenylcarbamoylamino)propyl]indole-2-carboxylic acid

Systemtic Name: 1,4-bis(chloranyl)-3-[3-(phenylcarbamoylamino)propyl]indole-2-carboxylic acid Openeye Name: 1,4-dichloro-3-[3-(phenylcarbamoylamino)propyl]indole-2-carboxylic acid CAS Name: 3-[3-[[anilino(oxo)methyl]amino]propyl]-1,4-dichloro-2-indolecarboxylic acid IUPAC Name: 1,4-dichloro-3-[3-(phenylcarbamoylamino)propyl]indole-2-carboxylic acid Traditional Name: 1,4-dichloro-3-[3-(phenylcarbamoylamino)propyl]indole-2-carboxylic acid Formula: C19H17Cl2N3O3 MolecularWeight: 406.26258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCCCC2=C(N(C3=C2C(=CC=C3)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCCCC2=C(N(C3=C2C(=CC=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C19H17Cl2N3O3/c20-14-9-4-10-15-16(14)13(17(18(25)26)24(15)21)8-5-11-22-19(27)23-12-6-2-1-3-7-12/h1-4,6-7,9-10H,5,8,11H2,(H,25,26)(H2,22,23,27)