[3-methoxy-5-(5-oxidanylideneoxolan-2-yl)-4-propyl-indol-3-yl]methyl 2-methylbenzoate

Systemtic Name: [3-methoxy-5-(5-oxidanylideneoxolan-2-yl)-4-propyl-indol-3-yl]methyl 2-methylbenzoate Openeye Name: [3-methoxy-5-(5-oxotetrahydrofuran-2-yl)-4-propyl-indol-3-yl]methyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-methoxy-5-(5-oxo-2-oxolanyl)-4-propyl-3-indolyl]methyl ester IUPAC Name: [3-methoxy-5-(5-oxooxolan-2-yl)-4-propylindol-3-yl]methyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [5-(5-ketotetrahydrofuran-2-yl)-3-methoxy-4-propyl-indol-3-yl]methyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1C(C=N2)(COC(=O)C3=CC=CC=C3C)OC)C4CCC(=O)O4

Isomeric SMILES

CCCC1=C(C=CC2=C1C(C=N2)(COC(=O)C3=CC=CC=C3C)OC)C4CCC(=O)O4

InChI

InChI=1S/C25H27NO5/c1-4-7-19-18(21-12-13-22(27)31-21)10-11-20-23(19)25(29-3,14-26-20)15-30-24(28)17-9-6-5-8-16(17)2/h5-6,8-11,14,21H,4,7,12-13,15H2,1-3H3