bis[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[[4-(phenylmethoxymethyl)phenyl]methyl]azanium

Systemtic Name: bis[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[[4-(phenylmethoxymethyl)phenyl]methyl]azanium Openeye Name: [4-(benzyloxymethyl)phenyl]methyl-bis[2-(cyclopropylamino)-2-oxo-ethyl]ammonium CAS Name: bis[2-(cyclopropylamino)-2-oxoethyl]-[[4-(phenylmethoxymethyl)phenyl]methyl]ammonium IUPAC Name: bis[2-(cyclopropylamino)-2-oxoethyl]-[[4-(phenylmethoxymethyl)phenyl]methyl]azanium Traditional Name: [4-(benzoxymethyl)benzyl]-bis[2-(cyclopropylamino)-2-keto-ethyl]ammonium Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+](CC2=CC=C(C=C2)COCC3=CC=CC=C3)CC(=O)NC4CC4

Isomeric SMILES

C1CC1NC(=O)C[NH+](CC2=CC=C(C=C2)COCC3=CC=CC=C3)CC(=O)NC4CC4

InChI

InChI=1S/C25H31N3O3/c29-24(26-22-10-11-22)15-28(16-25(30)27-23-12-13-23)14-19-6-8-21(9-7-19)18-31-17-20-4-2-1-3-5-20/h1-9,22-23H,10-18H2,(H,26,29)(H,27,30)/p+1