3-(2-azanylethyl)-1H-indol-5-ol; hexanedioic acid

Systemtic Name: 3-(2-azanylethyl)-1H-indol-5-ol; hexanedioic acid Openeye Name: adipic acid; 3-(2-aminoethyl)-1H-indol-5-ol CAS Name: 3-(2-aminoethyl)-1H-indol-5-ol; hexanedioic acid IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-ol; hexanedioic acid Traditional Name: adipic acid; 3-(2-aminoethyl)-1H-indol-5-ol Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CCN.C(CCC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)CCN.C(CCC(=O)O)CC(=O)O

InChI

InChI=1S/C10H12N2O.C6H10O4/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10;7-5(8)3-1-2-4-6(9)10/h1-2,5-6,12-13H,3-4,11H2;1-4H2,(H,7,8)(H,9,10)