methyl 1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]-3-(propylaminomethyl)indole-5-carboxylate

Systemtic Name: methyl 1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]-3-(propylaminomethyl)indole-5-carboxylate Openeye Name: methyl 1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]-3-(propylaminomethyl)indole-5-carboxylate CAS Name: 1-[2-(2-hydroxyphenyl)-2-phenylethyl]-3-(propylaminomethyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-hydroxyphenyl)-2-phenylethyl]-3-(propylaminomethyl)indole-5-carboxylate Traditional Name: 1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]-3-(propylaminomethyl)indole-5-carboxylic acid methyl ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(C3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CCCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(C3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C28H30N2O3/c1-3-15-29-17-22-18-30(26-14-13-21(16-24(22)26)28(32)33-2)19-25(20-9-5-4-6-10-20)23-11-7-8-12-27(23)31/h4-14,16,18,25,29,31H,3,15,17,19H2,1-2H3