2,4-bis(azanyl)-3-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethyl]benzoate

Systemtic Name: 2,4-bis(azanyl)-3-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethyl]benzoate Openeye Name: 2,4-diamino-3-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethyl]benzoate CAS Name: 2,4-diamino-3-[2-[4-(2-methoxyethyl)-1-piperazinyl]ethyl]benzoate IUPAC Name: 2,4-diamino-3-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethyl]benzoate Traditional Name: 2,4-diamino-3-[2-[4-(2-methoxyethyl)piperazino]ethyl]benzoate Formula: C16H25N4O3- MolecularWeight: 321.3947

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1)CCC2=C(C=CC(=C2N)C(=O)[O-])N

Isomeric SMILES

COCCN1CCN(CC1)CCC2=C(C=CC(=C2N)C(=O)[O-])N

InChI

InChI=1S/C16H26N4O3/c1-23-11-10-20-8-6-19(7-9-20)5-4-12-14(17)3-2-13(15(12)18)16(21)22/h2-3H,4-11,17-18H2,1H3,(H,21,22)/p-1