[3,4,5-triacetyloxy-6-[7-(phenylmethoxycarbonylamino)heptanoylamino]oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-[7-(phenylmethoxycarbonylamino)heptanoylamino]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[7-(benzyloxycarbonylamino)heptanoylamino]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[[1-oxo-7-(phenylmethoxycarbonylamino)heptyl]amino]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-[7-(phenylmethoxycarbonylamino)heptanoylamino]oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[7-(benzyloxycarbonylamino)heptanoylamino]tetrahydropyran-2-yl]methyl ester Formula: C29H40N2O12 MolecularWeight: 608.6341

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)NC(=O)CCCCCCNC(=O)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)NC(=O)CCCCCCNC(=O)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C29H40N2O12/c1-18(32)38-17-23-25(40-19(2)33)26(41-20(3)34)27(42-21(4)35)28(43-23)31-24(36)14-10-5-6-11-15-30-29(37)39-16-22-12-8-7-9-13-22/h7-9,12-13,23,25-28H,5-6,10-11,14-17H2,1-4H3,(H,30,37)(H,31,36)