2,2-bis(4-azanyl-3-butyl-phenyl)ethanoic acid

Systemtic Name: 2,2-bis(4-azanyl-3-butyl-phenyl)ethanoic acid Openeye Name: 2,2-bis(4-amino-3-butyl-phenyl)acetic acid CAS Name: 2,2-bis(4-amino-3-butylphenyl)acetic acid IUPAC Name: 2,2-bis(4-amino-3-butylphenyl)acetic acid Traditional Name: 2,2-bis(4-amino-3-butyl-phenyl)acetic acid Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)N)CCCC)C(=O)O)N

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)N)CCCC)C(=O)O)N

InChI

InChI=1S/C22H30N2O2/c1-3-5-7-15-13-17(9-11-19(15)23)21(22(25)26)18-10-12-20(24)16(14-18)8-6-4-2/h9-14,21H,3-8,23-24H2,1-2H3,(H,25,26)