(4S)-5-[(4-dimethylaminophenyl)amino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-5-[(4-dimethylaminophenyl)amino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-(tert-butoxycarbonylamino)-5-[4-(dimethylamino)anilino]-5-oxo-pentanoic acid CAS Name: (4S)-5-[4-(dimethylamino)anilino]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-5-[4-(dimethylamino)anilino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid Traditional Name: (4S)-4-(tert-butoxycarbonylamino)-5-[4-(dimethylamino)anilino]-5-keto-valeric acid Formula: C18H27N3O5 MolecularWeight: 365.42408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)O)C(=O)NC1=CC=C(C=C1)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)O)C(=O)NC1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C18H27N3O5/c1-18(2,3)26-17(25)20-14(10-11-15(22)23)16(24)19-12-6-8-13(9-7-12)21(4)5/h6-9,14H,10-11H2,1-5H3,(H,19,24)(H,20,25)(H,22,23)/t14-/m0/s1