tert-butyl 3-(2-dimethylaminoethyl)-5-[2-[(4-methoxyphenyl)methoxy]-2-oxidanylidene-ethyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-dimethylaminoethyl)-5-[2-[(4-methoxyphenyl)methoxy]-2-oxidanylidene-ethyl]indole-1-carboxylate Openeye Name: tert-butyl 3-(2-dimethylaminoethyl)-5-[2-[(4-methoxyphenyl)methoxy]-2-oxo-ethyl]indole-1-carboxylate CAS Name: 3-(2-dimethylaminoethyl)-5-[2-[(4-methoxyphenyl)methoxy]-2-oxoethyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-dimethylaminoethyl)-5-[2-[(4-methoxyphenyl)methoxy]-2-oxoethyl]indole-1-carboxylate Traditional Name: 3-(2-dimethylaminoethyl)-5-(2-keto-2-p-anisyloxy-ethyl)indole-1-carboxylic acid tert-butyl ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)CC(=O)OCC3=CC=C(C=C3)OC)CCN(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)CC(=O)OCC3=CC=C(C=C3)OC)CCN(C)C

InChI

InChI=1S/C27H34N2O5/c1-27(2,3)34-26(31)29-17-21(13-14-28(4)5)23-15-20(9-12-24(23)29)16-25(30)33-18-19-7-10-22(32-6)11-8-19/h7-12,15,17H,13-14,16,18H2,1-6H3