methyl 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-3-phenyl-propyl]indole-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(CC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(CC3=CC=CC=C3)C4=CC=CC=C4O

InChI

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