methyl 4,6-bis(chloranyl)-3-[2-(phenylcarbamoylamino)ethyl]-1H-indole-2-carboxylate

Systemtic Name: methyl 4,6-bis(chloranyl)-3-[2-(phenylcarbamoylamino)ethyl]-1H-indole-2-carboxylate Openeye Name: methyl 4,6-dichloro-3-[2-(phenylcarbamoylamino)ethyl]-1H-indole-2-carboxylate CAS Name: 3-[2-[[anilino(oxo)methyl]amino]ethyl]-4,6-dichloro-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 4,6-dichloro-3-[2-(phenylcarbamoylamino)ethyl]-1H-indole-2-carboxylate Traditional Name: 4,6-dichloro-3-[2-(phenylcarbamoylamino)ethyl]-1H-indole-2-carboxylic acid methyl ester Formula: C19H17Cl2N3O3 MolecularWeight: 406.26258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H17Cl2N3O3/c1-27-18(25)17-13(16-14(21)9-11(20)10-15(16)24-17)7-8-22-19(26)23-12-5-3-2-4-6-12/h2-6,9-10,24H,7-8H2,1H3,(H2,22,23,26)