4-azanylbutanoic acid; ethane-1,2-diamine; ethene; hexanedioic acid

Systemtic Name: 4-azanylbutanoic acid; ethane-1,2-diamine; ethene; hexanedioic acid Openeye Name: adipic acid; 4-aminobutanoic acid; ethane-1,2-diamine; ethylene CAS Name: 4-aminobutanoic acid; ethane-1,2-diamine; ethene; hexanedioic acid IUPAC Name: 4-aminobutanoic acid; ethane-1,2-diamine; ethene; hexanedioic acid Traditional Name: adipic acid; 4-aminobutyric acid; 2-aminoethylamine; ethylene Formula: C18H43N5O6 MolecularWeight: 425.56392

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Descriptors Computed from Structure

Canonical SMILES:

C=C.C=C.C(CCC(=O)O)CC(=O)O.C(CC(=O)O)CN.C(CN)N.C(CN)N

Isomeric SMILES

C=C.C=C.C(CCC(=O)O)CC(=O)O.C(CC(=O)O)CN.C(CN)N.C(CN)N

InChI

InChI=1S/C6H10O4.C4H9NO2.2C2H8N2.2C2H4/c7-5(8)3-1-2-4-6(9)10;5-3-1-2-4(6)7;2*3-1-2-4;2*1-2/h1-4H2,(H,7,8)(H,9,10);1-3,5H2,(H,6,7);2*1-4H2;2*1-2H2