hexan-2-yl 3-benzamidobutanoate

Systemtic Name: hexan-2-yl 3-benzamidobutanoate Openeye Name: 1-methylpentyl 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid hexan-2-yl ester IUPAC Name: hexan-2-yl 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid 1-methylpentyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)OC(=O)CC(C)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC(C)OC(=O)CC(C)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H25NO3/c1-4-5-9-14(3)21-16(19)12-13(2)18-17(20)15-10-7-6-8-11-15/h6-8,10-11,13-14H,4-5,9,12H2,1-3H3,(H,18,20)