tert-butyl (E)-2-[(2-cyanoethylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate

Systemtic Name: tert-butyl (E)-2-[(2-cyanoethylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate Openeye Name: tert-butyl (E)-2-[(2-cyanoethylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate CAS Name: (E)-2-[(2-cyanoethylamino)-(4-methyl-1-oxopentyl)amino]-5-phenyl-4-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-[(2-cyanoethylamino)-(4-methylpentanoyl)amino]-5-phenylpent-4-enoate Traditional Name: (E)-2-[(2-cyanoethylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoic acid tert-butyl ester Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CC=CC1=CC=CC=C1)C(=O)OC(C)(C)C)NCCC#N

Isomeric SMILES

CC(C)CCC(=O)N(C(C/C=C/C1=CC=CC=C1)C(=O)OC(C)(C)C)NCCC#N

InChI

InChI=1S/C24H35N3O3/c1-19(2)15-16-22(28)27(26-18-10-17-25)21(23(29)30-24(3,4)5)14-9-13-20-11-7-6-8-12-20/h6-9,11-13,19,21,26H,10,14-16,18H2,1-5H3/b13-9+