tert-butyl 3-(2-azanyl-2-diphenoxyphosphoryl-ethyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-azanyl-2-diphenoxyphosphoryl-ethyl)indole-1-carboxylate Openeye Name: tert-butyl 3-(2-amino-2-diphenoxyphosphoryl-ethyl)indole-1-carboxylate CAS Name: 3-(2-amino-2-diphenoxyphosphorylethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-amino-2-diphenoxyphosphorylethyl)indole-1-carboxylate Traditional Name: 3-(2-amino-2-diphenoxyphosphoryl-ethyl)indole-1-carboxylic acid tert-butyl ester Formula: C27H29N2O5P MolecularWeight: 492.503321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC(N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC(N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H29N2O5P/c1-27(2,3)32-26(30)29-19-20(23-16-10-11-17-24(23)29)18-25(28)35(31,33-21-12-6-4-7-13-21)34-22-14-8-5-9-15-22/h4-17,19,25H,18,28H2,1-3H3