4-[(6-methanoyl-3-propyl-indol-1-yl)methyl]-3-methoxy-benzoate

Systemtic Name: 4-[(6-methanoyl-3-propyl-indol-1-yl)methyl]-3-methoxy-benzoate Openeye Name: 4-[(6-formyl-3-propyl-indol-1-yl)methyl]-3-methoxy-benzoate CAS Name: 4-[(6-formyl-3-propyl-1-indolyl)methyl]-3-methoxybenzoate IUPAC Name: 4-[(6-formyl-3-propylindol-1-yl)methyl]-3-methoxybenzoate Traditional Name: 4-[(6-formyl-3-propyl-indol-1-yl)methyl]-3-methoxy-benzoate Formula: C21H20NO4- MolecularWeight: 350.3878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN(C2=C1C=CC(=C2)C=O)CC3=C(C=C(C=C3)C(=O)[O-])OC

Isomeric SMILES

CCCC1=CN(C2=C1C=CC(=C2)C=O)CC3=C(C=C(C=C3)C(=O)[O-])OC

InChI

InChI=1S/C21H21NO4/c1-3-4-16-11-22(19-9-14(13-23)5-8-18(16)19)12-17-7-6-15(21(24)25)10-20(17)26-2/h5-11,13H,3-4,12H2,1-2H3,(H,24,25)/p-1