methyl 5-azanyl-3-(4-tert-butylphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate

Systemtic Name: methyl 5-azanyl-3-(4-tert-butylphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Openeye Name: methyl 5-amino-3-(4-tert-butylphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate CAS Name: 5-amino-3-(4-tert-butylphenyl)-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-3-(4-tert-butylphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Traditional Name: 5-amino-3-(4-tert-butylphenyl)-1-m-anisyl-indole-2-carboxylic acid methyl ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)N)CC4=CC(=CC=C4)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)N)CC4=CC(=CC=C4)OC)C(=O)OC

InChI

InChI=1S/C28H30N2O3/c1-28(2,3)20-11-9-19(10-12-20)25-23-16-21(29)13-14-24(23)30(26(25)27(31)33-5)17-18-7-6-8-22(15-18)32-4/h6-16H,17,29H2,1-5H3