(phenylmethyl) N-[4-[[3-azanylpropyl(phenylcarbonyl)amino]methyl]phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-[[3-azanylpropyl(phenylcarbonyl)amino]methyl]phenyl]carbamate Openeye Name: benzyl N-[4-[[3-aminopropyl(benzoyl)amino]methyl]phenyl]carbamate CAS Name: N-[4-[[3-aminopropyl(benzoyl)amino]methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[[3-aminopropyl(benzoyl)amino]methyl]phenyl]carbamate Traditional Name: N-[4-[[3-aminopropyl(benzoyl)amino]methyl]phenyl]carbamic acid benzyl ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CC=C(C=C2)CN(CCCN)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CC=C(C=C2)CN(CCCN)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3/c26-16-7-17-28(24(29)22-10-5-2-6-11-22)18-20-12-14-23(15-13-20)27-25(30)31-19-21-8-3-1-4-9-21/h1-6,8-15H,7,16-19,26H2,(H,27,30)