4-[1-[5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]butyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[1-[5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]butyl]-3-methoxy-benzoic acid Openeye Name: 4-[1-[5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]butyl]-3-methoxy-benzoic acid CAS Name: 4-[1-[5-[2-[[dimethylamino(oxo)methyl]amino]ethyl]-1H-indol-3-yl]butyl]-3-methoxybenzoic acid IUPAC Name: 4-[1-[5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]butyl]-3-methoxybenzoic acid Traditional Name: 4-[1-[5-[2-(dimethylcarbamoylamino)ethyl]-1H-indol-3-yl]butyl]-3-methoxy-benzoic acid Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)C(=O)O)OC)C2=CNC3=C2C=C(C=C3)CCNC(=O)N(C)C

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)C(=O)O)OC)C2=CNC3=C2C=C(C=C3)CCNC(=O)N(C)C

InChI

InChI=1S/C25H31N3O4/c1-5-6-18(19-9-8-17(24(29)30)14-23(19)32-4)21-15-27-22-10-7-16(13-20(21)22)11-12-26-25(31)28(2)3/h7-10,13-15,18,27H,5-6,11-12H2,1-4H3,(H,26,31)(H,29,30)