(phenylmethyl) N-[2-oxidanylidene-1-(2-oxidanylideneheptyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[2-oxidanylidene-1-(2-oxidanylideneheptyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate Openeye Name: benzyl N-[2-oxo-1-(2-oxoheptyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[2-oxo-1-(2-oxoheptyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-oxo-1-(2-oxoheptyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[2-keto-1-(2-ketoheptyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamic acid benzyl ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H31N3O4/c1-2-3-6-17-24(34)20-33-26-19-12-11-18-25(26)27(23-15-9-5-10-16-23)31-28(29(33)35)32-30(36)37-21-22-13-7-4-8-14-22/h4-5,7-16,18-19,28H,2-3,6,17,20-21H2,1H3,(H,32,36)