(phenylmethyl) N-[(4-heptoxy-3-methoxy-phenyl)-(phenylmethoxycarbonylamino)methyl]carbamate

Systemtic Name: (phenylmethyl) N-[(4-heptoxy-3-methoxy-phenyl)-(phenylmethoxycarbonylamino)methyl]carbamate Openeye Name: benzyl N-[benzyloxycarbonylamino-(4-heptoxy-3-methoxy-phenyl)methyl]carbamate CAS Name: N-[(4-heptoxy-3-methoxyphenyl)-(phenylmethoxycarbonylamino)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(4-heptoxy-3-methoxyphenyl)-(phenylmethoxycarbonylamino)methyl]carbamate Traditional Name: N-[benzyloxycarbonylamino-(4-heptoxy-3-methoxy-phenyl)methyl]carbamic acid benzyl ester Formula: C31H38N2O6 MolecularWeight: 534.64322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)C(NC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)OC

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)C(NC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C31H38N2O6/c1-3-4-5-6-13-20-37-27-19-18-26(21-28(27)36-2)29(32-30(34)38-22-24-14-9-7-10-15-24)33-31(35)39-23-25-16-11-8-12-17-25/h7-12,14-19,21,29H,3-6,13,20,22-23H2,1-2H3,(H,32,34)(H,33,35)