3-[[(2,4-dimethoxyphenyl)methylamino]methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[[(2,4-dimethoxyphenyl)methylamino]methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-indole-2-carboxylic acid Openeye Name: 3-[[(2,4-dimethoxyphenyl)methylamino]methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-indole-2-carboxylic acid CAS Name: 3-[[(2,4-dimethoxyphenyl)methylamino]methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-2-indolecarboxylic acid IUPAC Name: 3-[[(2,4-dimethoxyphenyl)methylamino]methyl]-1-[(4-methoxyphenyl)methyl]-6-methylindole-2-carboxylic acid Traditional Name: 3-[[(2,4-dimethoxybenzyl)amino]methyl]-6-methyl-1-p-anisyl-indole-2-carboxylic acid Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=C(C=C3)OC)C(=O)O)CNCC4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=C(C=C3)OC)C(=O)O)CNCC4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C28H30N2O5/c1-18-5-12-23-24(16-29-15-20-8-11-22(34-3)14-26(20)35-4)27(28(31)32)30(25(23)13-18)17-19-6-9-21(33-2)10-7-19/h5-14,29H,15-17H2,1-4H3,(H,31,32)