methyl (3S)-4-[(2,5-dimethoxyphenyl)methyl-methyl-amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl (3S)-4-[(2,5-dimethoxyphenyl)methyl-methyl-amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl (3S)-3-(benzyloxycarbonylamino)-4-[(2,5-dimethoxyphenyl)methyl-methyl-amino]-4-oxo-butanoate CAS Name: (3S)-4-[(2,5-dimethoxyphenyl)methyl-methylamino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl (3S)-4-[(2,5-dimethoxyphenyl)methyl-methylamino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoate Traditional Name: (3S)-3-(benzyloxycarbonylamino)-4-[(2,5-dimethoxybenzyl)-methyl-amino]-4-keto-butyric acid methyl ester Formula: C23H28N2O7 MolecularWeight: 444.47762

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)OC)OC)C(=O)C(CC(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)OC)OC)C(=O)[C@H](CC(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O7/c1-25(14-17-12-18(29-2)10-11-20(17)30-3)22(27)19(13-21(26)31-4)24-23(28)32-15-16-8-6-5-7-9-16/h5-12,19H,13-15H2,1-4H3,(H,24,28)/t19-/m0/s1