methyl 3-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-[[4-(tert-butoxycarbonylamino)benzoyl]amino]-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-oxomethyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoyl]amino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-[[4-(tert-butoxycarbonylamino)benzoyl]amino]-4-pyrrolidino-benzoic acid methyl ester Formula: C24H29N3O5 MolecularWeight: 439.50416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCCC3

InChI

InChI=1S/C24H29N3O5/c1-24(2,3)32-23(30)25-18-10-7-16(8-11-18)21(28)26-19-15-17(22(29)31-4)9-12-20(19)27-13-5-6-14-27/h7-12,15H,5-6,13-14H2,1-4H3,(H,25,30)(H,26,28)