tert-butyl (E)-2-[azanyl(4-methylpentanoyl)amino]-2-(3-azanylpropanoyl)-5-phenyl-pent-4-enoate

Systemtic Name: tert-butyl (E)-2-[azanyl(4-methylpentanoyl)amino]-2-(3-azanylpropanoyl)-5-phenyl-pent-4-enoate Openeye Name: tert-butyl (E)-2-[amino(4-methylpentanoyl)amino]-2-(3-aminopropanoyl)-5-phenyl-pent-4-enoate CAS Name: (E)-2-[amino-(4-methyl-1-oxopentyl)amino]-2-(3-amino-1-oxopropyl)-5-phenyl-4-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-[amino(4-methylpentanoyl)amino]-2-(3-aminopropanoyl)-5-phenylpent-4-enoate Traditional Name: (E)-2-[amino(4-methylpentanoyl)amino]-2-(3-aminopropanoyl)-5-phenyl-pent-4-enoic acid tert-butyl ester Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CC=CC1=CC=CC=C1)(C(=O)CCN)C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C)CCC(=O)N(C(C/C=C/C1=CC=CC=C1)(C(=O)CCN)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C24H37N3O4/c1-18(2)13-14-21(29)27(26)24(20(28)15-17-25,22(30)31-23(3,4)5)16-9-12-19-10-7-6-8-11-19/h6-12,18H,13-17,25-26H2,1-5H3/b12-9+