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

Systemtic Name: tert-butyl (E)-2-[(2-methylbutylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate Openeye Name: tert-butyl (E)-2-[(2-methylbutylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate CAS Name: (E)-2-[(2-methylbutylamino)-(4-methyl-1-oxopentyl)amino]-5-phenyl-4-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-[(2-methylbutylamino)-(4-methylpentanoyl)amino]-5-phenylpent-4-enoate Traditional Name: (E)-2-[(2-methylbutylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoic acid tert-butyl ester Formula: C26H42N2O3 MolecularWeight: 430.62328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNN(C(CC=CC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)CCC(C)C

Isomeric SMILES

CCC(C)CNN(C(C/C=C/C1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)CCC(C)C

InChI

InChI=1S/C26H42N2O3/c1-8-21(4)19-27-28(24(29)18-17-20(2)3)23(25(30)31-26(5,6)7)16-12-15-22-13-10-9-11-14-22/h9-15,20-21,23,27H,8,16-19H2,1-7H3/b15-12+