[1-[(1-cyano-2-phenylmethoxy-ethyl)-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl] N-(phenylmethyl)carbamate Openeye Name: [1-[(2-benzyloxy-1-cyano-ethyl)-methyl-carbamoyl]-3-methyl-butyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[(1-cyano-2-phenylmethoxyethyl)-methylamino]-4-methyl-1-oxopentan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)-methylamino]-4-methyl-1-oxopentan-2-yl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [1-[(2-benzoxy-1-cyano-ethyl)-methyl-carbamoyl]-3-methyl-butyl] ester Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C)C(COCC1=CC=CC=C1)C#N)OC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)N(C)C(COCC1=CC=CC=C1)C#N)OC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C25H31N3O4/c1-19(2)14-23(32-25(30)27-16-20-10-6-4-7-11-20)24(29)28(3)22(15-26)18-31-17-21-12-8-5-9-13-21/h4-13,19,22-23H,14,16-18H2,1-3H3,(H,27,30)