methyl 2-[2-azanylhexanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl 2-[2-azanylhexanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl 2-[2-aminohexanoyl(tert-butoxycarbonyl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[(2-amino-1-oxohexyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[2-aminohexanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[2-aminohexanoyl(tert-butoxycarbonyl)amino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O6/c1-6-7-8-16(22)18(25)23(20(27)29-21(2,3)4)17(19(26)28-5)13-14-9-11-15(24)12-10-14/h9-12,16-17,24H,6-8,13,22H2,1-5H3