4-[[6-(6-acetamidohexanoylamino)indol-1-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[6-(6-acetamidohexanoylamino)indol-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[6-(6-acetamidohexanoylamino)indol-1-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[6-[(6-acetamido-1-oxohexyl)amino]-1-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[6-(6-acetamidohexanoylamino)indol-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[6-(6-acetamidohexanoylamino)indol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCCCC(=O)NC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CC(=O)NCCCCCC(=O)NC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C25H29N3O5/c1-17(29)26-12-5-3-4-6-24(30)27-21-10-9-18-11-13-28(22(18)15-21)16-20-8-7-19(25(31)32)14-23(20)33-2/h7-11,13-15H,3-6,12,16H2,1-2H3,(H,26,29)(H,27,30)(H,31,32)