[1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl] N-quinolin-2-ylcarbamate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl] N-quinolin-2-ylcarbamate Openeye Name: [1-[(2-benzyloxy-1-cyano-ethyl)carbamoyl]-2-methyl-butyl] N-(2-quinolyl)carbamate CAS Name: N-(2-quinolinyl)carbamic acid [1-[(1-cyano-2-phenylmethoxyethyl)amino]-3-methyl-1-oxopentan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)amino]-3-methyl-1-oxopentan-2-yl] N-quinolin-2-ylcarbamate Traditional Name: N-(2-quinolyl)carbamic acid [1-[(2-benzoxy-1-cyano-ethyl)carbamoyl]-2-methyl-butyl] ester Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(COCC1=CC=CC=C1)C#N)OC(=O)NC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C)C(C(=O)NC(COCC1=CC=CC=C1)C#N)OC(=O)NC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C26H28N4O4/c1-3-18(2)24(25(31)28-21(15-27)17-33-16-19-9-5-4-6-10-19)34-26(32)30-23-14-13-20-11-7-8-12-22(20)29-23/h4-14,18,21,24H,3,16-17H2,1-2H3,(H,28,31)(H,29,30,32)