methyl 4-[3-[2-[(2,6-dimethylphenyl)amino]ethylamino]-2-oxidanyl-propoxy]-1H-indole-6-carboxylate

Systemtic Name: methyl 4-[3-[2-[(2,6-dimethylphenyl)amino]ethylamino]-2-oxidanyl-propoxy]-1H-indole-6-carboxylate Openeye Name: methyl 4-[3-[2-(2,6-dimethylanilino)ethylamino]-2-hydroxy-propoxy]-1H-indole-6-carboxylate CAS Name: 4-[3-[2-(2,6-dimethylanilino)ethylamino]-2-hydroxypropoxy]-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 4-[3-[2-(2,6-dimethylanilino)ethylamino]-2-hydroxypropoxy]-1H-indole-6-carboxylate Traditional Name: 4-[3-[2-(2,6-dimethylanilino)ethylamino]-2-hydroxy-propoxy]-1H-indole-6-carboxylic acid methyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NCCNCC(COC2=CC(=CC3=C2C=CN3)C(=O)OC)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NCCNCC(COC2=CC(=CC3=C2C=CN3)C(=O)OC)O

InChI

InChI=1S/C23H29N3O4/c1-15-5-4-6-16(2)22(15)26-10-9-24-13-18(27)14-30-21-12-17(23(28)29-3)11-20-19(21)7-8-25-20/h4-8,11-12,18,24-27H,9-10,13-14H2,1-3H3