6-azanyl-3-[[4-azanyl-3-carboxylato-2-(2-dimethylaminoethyl)phenyl]methyl]-2-(2-dimethylaminoethyl)benzoate

Systemtic Name: 6-azanyl-3-[[4-azanyl-3-carboxylato-2-(2-dimethylaminoethyl)phenyl]methyl]-2-(2-dimethylaminoethyl)benzoate Openeye Name: 6-amino-3-[[4-amino-3-carboxylato-2-(2-dimethylaminoethyl)phenyl]methyl]-2-(2-dimethylaminoethyl)benzoate CAS Name: 6-amino-3-[[4-amino-3-carboxylato-2-(2-dimethylaminoethyl)phenyl]methyl]-2-(2-dimethylaminoethyl)benzoate IUPAC Name: 6-amino-3-[[4-amino-3-carboxylato-2-(2-dimethylaminoethyl)phenyl]methyl]-2-(2-dimethylaminoethyl)benzoate Traditional Name: 6-amino-3-[4-amino-3-carboxylato-2-(2-dimethylaminoethyl)benzyl]-2-(2-dimethylaminoethyl)benzoate Formula: C23H30N4O4-2 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=C(C=CC(=C1C(=O)[O-])N)CC2=C(C(=C(C=C2)N)C(=O)[O-])CCN(C)C

Isomeric SMILES

CN(C)CCC1=C(C=CC(=C1C(=O)[O-])N)CC2=C(C(=C(C=C2)N)C(=O)[O-])CCN(C)C

InChI

InChI=1S/C23H32N4O4/c1-26(2)11-9-16-14(5-7-18(24)20(16)22(28)29)13-15-6-8-19(25)21(23(30)31)17(15)10-12-27(3)4/h5-8H,9-13,24-25H2,1-4H3,(H,28,29)(H,30,31)/p-2