4-[1-[2,6-bis(chloranyl)-5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]ethyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[1-[2,6-bis(chloranyl)-5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]ethyl]-3-methoxy-benzoic acid Openeye Name: 4-[1-[2,6-dichloro-5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]ethyl]-3-methoxy-benzoic acid CAS Name: 4-[1-[2,6-dichloro-5-[2-[[dimethylamino(oxo)methyl]amino]ethyl]-1H-indol-3-yl]ethyl]-3-methoxybenzoic acid IUPAC Name: 4-[1-[2,6-dichloro-5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]ethyl]-3-methoxybenzoic acid Traditional Name: 4-[1-[2,6-dichloro-5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]ethyl]-3-methoxy-benzoic acid Formula: C23H25Cl2N3O4 MolecularWeight: 478.3683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)O)OC)C2=C(NC3=CC(=C(C=C32)CCNC(=O)N(C)C)Cl)Cl

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)O)OC)C2=C(NC3=CC(=C(C=C32)CCNC(=O)N(C)C)Cl)Cl

InChI

InChI=1S/C23H25Cl2N3O4/c1-12(15-6-5-14(22(29)30)10-19(15)32-4)20-16-9-13(7-8-26-23(31)28(2)3)17(24)11-18(16)27-21(20)25/h5-6,9-12,27H,7-8H2,1-4H3,(H,26,31)(H,29,30)