(7-methoxycarbonyl-10-phenylmethoxy-henicosan-8-yl) benzoate

Systemtic Name: (7-methoxycarbonyl-10-phenylmethoxy-henicosan-8-yl) benzoate Openeye Name: [3-benzyloxy-1-(1-methoxycarbonylheptyl)tetradecyl] benzoate CAS Name: benzoic acid (7-methoxycarbonyl-10-phenylmethoxyheneicosan-8-yl) ester IUPAC Name: (7-methoxycarbonyl-10-phenylmethoxyhenicosan-8-yl) benzoate Traditional Name: benzoic acid [3-benzoxy-1-(1-carbomethoxyheptyl)tetradecyl] ester Formula: C37H56O5 MolecularWeight: 580.83754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)OC)OC(=O)C1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)OC)OC(=O)C1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C37H56O5/c1-4-6-8-10-11-12-13-14-21-27-33(41-30-31-23-17-15-18-24-31)29-35(42-36(38)32-25-19-16-20-26-32)34(37(39)40-3)28-22-9-7-5-2/h15-20,23-26,33-35H,4-14,21-22,27-30H2,1-3H3