(2S)-2-[(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hept-6-enoic acid

Systemtic Name: (2S)-2-[(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hept-6-enoic acid Openeye Name: (2S)-2-[tert-butoxycarbonyl-[(4-methoxyphenyl)methyl]amino]hept-6-enoic acid CAS Name: (2S)-2-[(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-heptenoic acid IUPAC Name: (2S)-2-[(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hept-6-enoic acid Traditional Name: (2S)-2-[tert-butoxycarbonyl(p-anisyl)amino]hept-6-enoic acid Formula: C20H29NO5 MolecularWeight: 363.44796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)OC)C(CCCC=C)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)OC)[C@@H](CCCC=C)C(=O)O

InChI

InChI=1S/C20H29NO5/c1-6-7-8-9-17(18(22)23)21(19(24)26-20(2,3)4)14-15-10-12-16(25-5)13-11-15/h6,10-13,17H,1,7-9,14H2,2-5H3,(H,22,23)/t17-/m0/s1