2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]butanedioic acid

Systemtic Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]butanedioic acid Openeye Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]butanedioic acid CAS Name: 2-[[2-(2-dimethylaminoethyl)-4-quinazolinyl]amino]butanedioic acid IUPAC Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]butanedioic acid Traditional Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]succinic acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=NC2=CC=CC=C2C(=N1)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CCC1=NC2=CC=CC=C2C(=N1)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C16H20N4O4/c1-20(2)8-7-13-17-11-6-4-3-5-10(11)15(19-13)18-12(16(23)24)9-14(21)22/h3-6,12H,7-9H2,1-2H3,(H,21,22)(H,23,24)(H,17,18,19)