[2-oxidanylidene-5-[1-(phenylmethoxycarbonylamino)ethyl]-3-(phenylmethyl)cyclohept-4-en-1-yl] ethanoate

Systemtic Name: [2-oxidanylidene-5-[1-(phenylmethoxycarbonylamino)ethyl]-3-(phenylmethyl)cyclohept-4-en-1-yl] ethanoate Openeye Name: [3-benzyl-5-[1-(benzyloxycarbonylamino)ethyl]-2-oxo-cyclohept-4-en-1-yl] acetate CAS Name: acetic acid [2-oxo-5-[1-(phenylmethoxycarbonylamino)ethyl]-3-(phenylmethyl)-1-cyclohept-4-enyl] ester IUPAC Name: [3-benzyl-2-oxo-5-[1-(phenylmethoxycarbonylamino)ethyl]cyclohept-4-en-1-yl] acetate Traditional Name: acetic acid [3-benzyl-5-[1-(benzyloxycarbonylamino)ethyl]-2-keto-cyclohept-4-en-1-yl] ester Formula: C26H29NO5 MolecularWeight: 435.51216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(C(=O)C(CC1)OC(=O)C)CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC(C(=O)C(CC1)OC(=O)C)CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO5/c1-18(27-26(30)31-17-21-11-7-4-8-12-21)22-13-14-24(32-19(2)28)25(29)23(16-22)15-20-9-5-3-6-10-20/h3-12,16,18,23-24H,13-15,17H2,1-2H3,(H,27,30)