N-(1-cyano-2-phenylmethoxy-ethyl)-4-morpholin-4-yl-2-(naphthalen-2-ylmethyl)-4-oxidanylidene-butanamide

Systemtic Name: N-(1-cyano-2-phenylmethoxy-ethyl)-4-morpholin-4-yl-2-(naphthalen-2-ylmethyl)-4-oxidanylidene-butanamide Openeye Name: N-(2-benzyloxy-1-cyano-ethyl)-4-morpholino-2-(2-naphthylmethyl)-4-oxo-butanamide CAS Name: N-(1-cyano-2-phenylmethoxyethyl)-4-(4-morpholinyl)-2-(2-naphthalenylmethyl)-4-oxobutanamide IUPAC Name: N-(1-cyano-2-phenylmethoxyethyl)-4-morpholin-4-yl-2-(naphthalen-2-ylmethyl)-4-oxobutanamide Traditional Name: N-(2-benzoxy-1-cyano-ethyl)-4-keto-4-morpholino-2-(2-naphthylmethyl)butyramide Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC(CC2=CC3=CC=CC=C3C=C2)C(=O)NC(COCC4=CC=CC=C4)C#N

Isomeric SMILES

C1COCCN1C(=O)CC(CC2=CC3=CC=CC=C3C=C2)C(=O)NC(COCC4=CC=CC=C4)C#N

InChI

InChI=1S/C29H31N3O4/c30-19-27(21-36-20-22-6-2-1-3-7-22)31-29(34)26(18-28(33)32-12-14-35-15-13-32)17-23-10-11-24-8-4-5-9-25(24)16-23/h1-11,16,26-27H,12-15,17-18,20-21H2,(H,31,34)