methyl 1-(2,2-diphenylethyl)-3-[(2-methylpropylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-(2,2-diphenylethyl)-3-[(2-methylpropylamino)methyl]indole-5-carboxylate Openeye Name: methyl 1-(2,2-diphenylethyl)-3-[(isobutylamino)methyl]indole-5-carboxylate CAS Name: 1-(2,2-diphenylethyl)-3-[(2-methylpropylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2,2-diphenylethyl)-3-[(2-methylpropylamino)methyl]indole-5-carboxylate Traditional Name: 1-(2,2-diphenylethyl)-3-[(isobutylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C29H32N2O2 MolecularWeight: 440.57658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O2/c1-21(2)17-30-18-25-19-31(28-15-14-24(16-26(25)28)29(32)33-3)20-27(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-16,19,21,27,30H,17-18,20H2,1-3H3