7-azanyl-7-azanylidene-2-[6-(4-hydroxyphenyl)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]heptanoic acid

Systemtic Name: 7-azanyl-7-azanylidene-2-[6-(4-hydroxyphenyl)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]heptanoic acid Openeye Name: 7-amino-2-[2-hydroxy-6-(4-hydroxyphenyl)indan-1-yl]-7-imino-heptanoic acid CAS Name: 7-amino-2-[2-hydroxy-6-(4-hydroxyphenyl)-2,3-dihydro-1H-inden-1-yl]-7-iminoheptanoic acid IUPAC Name: 7-amino-2-[2-hydroxy-6-(4-hydroxyphenyl)-2,3-dihydro-1H-inden-1-yl]-7-iminoheptanoic acid Traditional Name: 7-amino-2-[2-hydroxy-6-(4-hydroxyphenyl)indan-1-yl]-7-imino-enanthic acid Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=C1C=CC(=C2)C3=CC=C(C=C3)O)C(CCCCC(=N)N)C(=O)O)O

Isomeric SMILES

C1C(C(C2=C1C=CC(=C2)C3=CC=C(C=C3)O)C(CCCCC(=N)N)C(=O)O)O

InChI

InChI=1S/C22H26N2O4/c23-20(24)4-2-1-3-17(22(27)28)21-18-11-14(5-6-15(18)12-19(21)26)13-7-9-16(25)10-8-13/h5-11,17,19,21,25-26H,1-4,12H2,(H3,23,24)(H,27,28)