methyl 2-[[5-methoxy-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[5-methoxy-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(benzyloxycarbonylamino)-5-methoxy-5-oxo-pentanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[5-methoxy-1,5-dioxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[5-methoxy-5-oxo-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-5-keto-5-methoxy-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C21H30N2O7 MolecularWeight: 422.4721

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C(CCC(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C(CCC(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H30N2O7/c1-14(2)12-17(20(26)29-4)22-19(25)16(10-11-18(24)28-3)23-21(27)30-13-15-8-6-5-7-9-15/h5-9,14,16-17H,10-13H2,1-4H3,(H,22,25)(H,23,27)