methyl-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-[2-methyl-3-oxidanylidene-4-(pyrrolidin-2-ylmethoxy)butanoyl]-phenylmethoxy-azanium

Systemtic Name: methyl-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-[2-methyl-3-oxidanylidene-4-(pyrrolidin-2-ylmethoxy)butanoyl]-phenylmethoxy-azanium Openeye Name: [1-benzyl-2-(methylamino)-2-oxo-ethyl]-benzyloxy-methyl-[2-methyl-3-oxo-4-(pyrrolidin-2-ylmethoxy)butanoyl]ammonium CAS Name: methyl-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-[2-methyl-1,3-dioxo-4-(2-pyrrolidinylmethoxy)butyl]-phenylmethoxyammonium IUPAC Name: methyl-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-[2-methyl-3-oxo-4-(pyrrolidin-2-ylmethoxy)butanoyl]-phenylmethoxyazanium Traditional Name: benzoxy-[1-benzyl-2-keto-2-(methylamino)ethyl]-[3-keto-2-methyl-4-(pyrrolidin-2-ylmethoxy)butanoyl]-methyl-ammonium Formula: C28H38N3O5+ MolecularWeight: 496.61842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)COCC1CCCN1)C(=O)[N+](C)(C(CC2=CC=CC=C2)C(=O)NC)OCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)COCC1CCCN1)C(=O)[N+](C)(C(CC2=CC=CC=C2)C(=O)NC)OCC3=CC=CC=C3

InChI

InChI=1S/C28H37N3O5/c1-21(26(32)20-35-19-24-15-10-16-30-24)28(34)31(3,36-18-23-13-8-5-9-14-23)25(27(33)29-2)17-22-11-6-4-7-12-22/h4-9,11-14,21,24-25,30H,10,15-20H2,1-3H3/p+1