tert-butyl 3-[(2-methoxyphenyl)methyl-methyl-amino]-3-oxidanylidene-2-(phenylmethyl)-2-(prop-2-enylamino)propanoate

Systemtic Name: tert-butyl 3-[(2-methoxyphenyl)methyl-methyl-amino]-3-oxidanylidene-2-(phenylmethyl)-2-(prop-2-enylamino)propanoate Openeye Name: tert-butyl 2-(allylamino)-2-benzyl-3-[(2-methoxyphenyl)methyl-methyl-amino]-3-oxo-propanoate CAS Name: 3-[(2-methoxyphenyl)methyl-methylamino]-3-oxo-2-(phenylmethyl)-2-(prop-2-enylamino)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-benzyl-3-[(2-methoxyphenyl)methyl-methylamino]-3-oxo-2-(prop-2-enylamino)propanoate Traditional Name: 2-(allylamino)-2-benzyl-3-keto-3-[methyl(o-anisyl)amino]propionic acid tert-butyl ester Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)(C(=O)N(C)CC2=CC=CC=C2OC)NCC=C

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)(C(=O)N(C)CC2=CC=CC=C2OC)NCC=C

InChI

InChI=1S/C26H34N2O4/c1-7-17-27-26(24(30)32-25(2,3)4,18-20-13-9-8-10-14-20)23(29)28(5)19-21-15-11-12-16-22(21)31-6/h7-16,27H,1,17-19H2,2-6H3