dimethyl-[[1-methyl-4-[4-(phenylmethoxycarbonylamino)butanoylamino]pyrrol-2-yl]carbonylamino]-propyl-azanium

Systemtic Name: dimethyl-[[1-methyl-4-[4-(phenylmethoxycarbonylamino)butanoylamino]pyrrol-2-yl]carbonylamino]-propyl-azanium Openeye Name: [[4-[4-(benzyloxycarbonylamino)butanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-dimethyl-propyl-ammonium CAS Name: dimethyl-[[[1-methyl-4-[[1-oxo-4-(phenylmethoxycarbonylamino)butyl]amino]-2-pyrrolyl]-oxomethyl]amino]-propylammonium IUPAC Name: dimethyl-[[1-methyl-4-[4-(phenylmethoxycarbonylamino)butanoylamino]pyrrole-2-carbonyl]amino]-propylazanium Traditional Name: [[4-[4-(benzyloxycarbonylamino)butanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-dimethyl-propyl-ammonium Formula: C23H34N5O4+ MolecularWeight: 444.54716

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)NC(=O)C1=CC(=CN1C)NC(=O)CCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC[N+](C)(C)NC(=O)C1=CC(=CN1C)NC(=O)CCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H33N5O4/c1-5-14-28(3,4)26-22(30)20-15-19(16-27(20)2)25-21(29)12-9-13-24-23(31)32-17-18-10-7-6-8-11-18/h6-8,10-11,15-16H,5,9,12-14,17H2,1-4H3,(H2-,24,25,26,29,30,31)/p+1