methyl 4-[[6-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]benzoate

Systemtic Name: methyl 4-[[6-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]benzoate Openeye Name: methyl 4-[[6-amino-2-(tert-butoxycarbonylamino)hexanoyl]amino]benzoate CAS Name: 4-[[6-amino-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]benzoate Traditional Name: 4-[[6-amino-2-(tert-butoxycarbonylamino)hexanoyl]amino]benzoic acid methyl ester Formula: C19H29N3O5 MolecularWeight: 379.45066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCN)C(=O)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCCN)C(=O)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C19H29N3O5/c1-19(2,3)27-18(25)22-15(7-5-6-12-20)16(23)21-14-10-8-13(9-11-14)17(24)26-4/h8-11,15H,5-7,12,20H2,1-4H3,(H,21,23)(H,22,25)