tert-butyl N-[3-[3-cyanopropyl-(phenylmethyl)amino]-1-phenyl-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[3-cyanopropyl-(phenylmethyl)amino]-1-phenyl-propyl]carbamate Openeye Name: tert-butyl N-[3-[benzyl(3-cyanopropyl)amino]-1-phenyl-propyl]carbamate CAS Name: N-[3-[3-cyanopropyl-(phenylmethyl)amino]-1-phenylpropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[benzyl(3-cyanopropyl)amino]-1-phenylpropyl]carbamate Traditional Name: N-[3-[benzyl(3-cyanopropyl)amino]-1-phenyl-propyl]carbamic acid tert-butyl ester Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCN(CCCC#N)CC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCN(CCCC#N)CC1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C25H33N3O2/c1-25(2,3)30-24(29)27-23(22-14-8-5-9-15-22)16-19-28(18-11-10-17-26)20-21-12-6-4-7-13-21/h4-9,12-15,23H,10-11,16,18-20H2,1-3H3,(H,27,29)