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

Systemtic Name: (phenylmethyl) N-[4-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]carbamate Openeye Name: benzyl N-[4-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]carbamate CAS Name: N-[4-[[3-aminopropyl-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]carbamate Traditional Name: N-[4-[[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=C(C=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

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

InChI

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