methyl (3S)-2-acetyloxy-7-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethoxycarbonylamino)heptanoate

Systemtic Name: methyl (3S)-2-acetyloxy-7-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethoxycarbonylamino)heptanoate Openeye Name: methyl (3S)-2-acetoxy-3-(benzyloxycarbonylamino)-7-(tert-butoxycarbonylamino)heptanoate CAS Name: (3S)-2-acetyloxy-7-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(phenylmethoxycarbonylamino)heptanoic acid methyl ester IUPAC Name: methyl (3S)-2-acetyloxy-7-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethoxycarbonylamino)heptanoate Traditional Name: (3S)-2-acetoxy-3-(benzyloxycarbonylamino)-7-(tert-butoxycarbonylamino)enanthic acid methyl ester Formula: C23H34N2O8 MolecularWeight: 466.52466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)OC([C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C23H34N2O8/c1-16(26)32-19(20(27)30-5)18(13-9-10-14-24-21(28)33-23(2,3)4)25-22(29)31-15-17-11-7-6-8-12-17/h6-8,11-12,18-19H,9-10,13-15H2,1-5H3,(H,24,28)(H,25,29)/t18-,19?/m0/s1