[4-[[(3,5-dimethylphenyl)methyl-phenylmethoxycarbonyl-amino]methyl]phenyl]methyl 3,5-dimethylbenzoate

Systemtic Name: [4-[[(3,5-dimethylphenyl)methyl-phenylmethoxycarbonyl-amino]methyl]phenyl]methyl 3,5-dimethylbenzoate Openeye Name: [4-[[benzyloxycarbonyl-[(3,5-dimethylphenyl)methyl]amino]methyl]phenyl]methyl 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid [4-[[(3,5-dimethylphenyl)methyl-phenylmethoxycarbonylamino]methyl]phenyl]methyl ester IUPAC Name: [4-[[(3,5-dimethylphenyl)methyl-phenylmethoxycarbonylamino]methyl]phenyl]methyl 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid [4-[[carbobenzoxy-(3,5-dimethylbenzyl)amino]methyl]benzyl] ester Formula: C34H35NO4 MolecularWeight: 521.646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN(CC2=CC=C(C=C2)COC(=O)C3=CC(=CC(=C3)C)C)C(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN(CC2=CC=C(C=C2)COC(=O)C3=CC(=CC(=C3)C)C)C(=O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C34H35NO4/c1-24-14-25(2)17-31(16-24)21-35(34(37)39-23-29-8-6-5-7-9-29)20-28-10-12-30(13-11-28)22-38-33(36)32-18-26(3)15-27(4)19-32/h5-19H,20-23H2,1-4H3