3-cyanopropyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: 3-cyanopropyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: 3-cyanopropyl 3-(tert-butoxycarbonylamino)benzoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 3-(tert-butoxycarbonylamino)benzoic acid 3-cyanopropyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)OCCCC#N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)OCCCC#N

InChI

InChI=1S/C16H20N2O4/c1-16(2,3)22-15(20)18-13-8-6-7-12(11-13)14(19)21-10-5-4-9-17/h6-8,11H,4-5,10H2,1-3H3,(H,18,20)