methyl 4-[[6-(hexanoylamino)-2,3-dimethyl-indol-1-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[6-(hexanoylamino)-2,3-dimethyl-indol-1-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[6-(hexanoylamino)-2,3-dimethyl-indol-1-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[2,3-dimethyl-6-(1-oxohexylamino)-1-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[6-(hexanoylamino)-2,3-dimethylindol-1-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[6-(caproylamino)-2,3-dimethyl-indol-1-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC2=C(C=C1)C(=C(N2CC3=C(C=C(C=C3)C(=O)OC)OC)C)C

Isomeric SMILES

CCCCCC(=O)NC1=CC2=C(C=C1)C(=C(N2CC3=C(C=C(C=C3)C(=O)OC)OC)C)C

InChI

InChI=1S/C26H32N2O4/c1-6-7-8-9-25(29)27-21-12-13-22-17(2)18(3)28(23(22)15-21)16-20-11-10-19(26(30)32-5)14-24(20)31-4/h10-15H,6-9,16H2,1-5H3,(H,27,29)