(phenylmethyl) N-[6-[2-cyanoethyl-(phenylmethyl)amino]-6-oxidanylidene-hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[6-[2-cyanoethyl-(phenylmethyl)amino]-6-oxidanylidene-hexyl]carbamate Openeye Name: benzyl N-[6-[benzyl(2-cyanoethyl)amino]-6-oxo-hexyl]carbamate CAS Name: N-[6-[2-cyanoethyl-(phenylmethyl)amino]-6-oxohexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[6-[benzyl(2-cyanoethyl)amino]-6-oxohexyl]carbamate Traditional Name: N-[6-[benzyl(2-cyanoethyl)amino]-6-keto-hexyl]carbamic acid benzyl ester Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)C(=O)CCCCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)C(=O)CCCCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H29N3O3/c25-16-10-18-27(19-21-11-4-1-5-12-21)23(28)15-8-3-9-17-26-24(29)30-20-22-13-6-2-7-14-22/h1-2,4-7,11-14H,3,8-10,15,17-20H2,(H,26,29)