[1-[tert-butyl(nitro)amino]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] benzoate

Systemtic Name: [1-[tert-butyl(nitro)amino]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] benzoate Openeye Name: [1-[[tert-butyl(nitro)amino]methyl]-2-[(2-methyl-1H-indol-4-yl)oxy]ethyl] benzoate CAS Name: benzoic acid [1-[tert-butyl(nitro)amino]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] ester IUPAC Name: [1-[tert-butyl(nitro)amino]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] benzoate Traditional Name: benzoic acid [1-[[tert-butyl(nitro)amino]methyl]-2-[(2-methyl-1H-indol-4-yl)oxy]ethyl] ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1)C=CC=C2OCC(CN(C(C)(C)C)[N+](=O)[O-])OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(N1)C=CC=C2OCC(CN(C(C)(C)C)[N+](=O)[O-])OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O5/c1-16-13-19-20(24-16)11-8-12-21(19)30-15-18(14-25(26(28)29)23(2,3)4)31-22(27)17-9-6-5-7-10-17/h5-13,18,24H,14-15H2,1-4H3