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

Systemtic Name: (phenylmethyl) N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]carbamate Openeye Name: benzyl N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]carbamate CAS Name: N-[3-[[3-aminopropyl-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]carbamate Traditional Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]carbamic acid benzyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC1C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c23-12-5-13-25(21(26)19-10-11-19)15-18-8-4-9-20(14-18)24-22(27)28-16-17-6-2-1-3-7-17/h1-4,6-9,14,19H,5,10-13,15-16,23H2,(H,24,27)