[5-[(1H-indol-2-ylmethylamino)methyl]-2-methoxy-phenyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [5-[(1H-indol-2-ylmethylamino)methyl]-2-methoxy-phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [5-[(1H-indol-2-ylmethylamino)methyl]-2-methoxy-phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [5-[(1H-indol-2-ylmethylamino)methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[(1H-indol-2-ylmethylamino)methyl]-2-methoxyphenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [5-[(1H-indol-2-ylmethylamino)methyl]-2-methoxy-phenyl] ester Formula: C27H28N2O6 MolecularWeight: 476.52102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCC2=CC3=CC=CC=C3N2)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNCC2=CC3=CC=CC=C3N2)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C27H28N2O6/c1-31-22-10-9-17(15-28-16-20-12-18-7-5-6-8-21(18)29-20)11-23(22)35-27(30)19-13-24(32-2)26(34-4)25(14-19)33-3/h5-14,28-29H,15-16H2,1-4H3