(2-nitrophenyl)methyl 1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate Openeye Name: (2-nitrophenyl)methyl 1-[2-(tert-butylamino)-2-oxo-ethyl]cyclopentanecarboxylate CAS Name: 1-[2-(tert-butylamino)-2-oxoethyl]-1-cyclopentanecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 1-[2-(tert-butylamino)-2-oxoethyl]cyclopentane-1-carboxylate Traditional Name: 1-[2-(tert-butylamino)-2-keto-ethyl]cyclopentanecarboxylic acid (2-nitrobenzyl) ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CC1(CCCC1)C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)CC1(CCCC1)C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H26N2O5/c1-18(2,3)20-16(22)12-19(10-6-7-11-19)17(23)26-13-14-8-4-5-9-15(14)21(24)25/h4-5,8-9H,6-7,10-13H2,1-3H3,(H,20,22)