4-[2-[1-[2-(azonan-1-yl)phenyl]ethylamino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 4-[2-[1-[2-(azonan-1-yl)phenyl]ethylamino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 4-[2-[1-[2-(azonan-1-yl)phenyl]ethylamino]-2-oxo-ethyl]benzoic acid CAS Name: 4-[2-[1-[2-(1-azonanyl)phenyl]ethylamino]-2-oxoethyl]benzoic acid IUPAC Name: 4-[2-[1-[2-(azonan-1-yl)phenyl]ethylamino]-2-oxoethyl]benzoic acid Traditional Name: 4-[2-[1-[2-(azonan-1-yl)phenyl]ethylamino]-2-keto-ethyl]benzoic acid Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1N2CCCCCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1N2CCCCCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C25H32N2O3/c1-19(26-24(28)18-20-12-14-21(15-13-20)25(29)30)22-10-6-7-11-23(22)27-16-8-4-2-3-5-9-17-27/h6-7,10-15,19H,2-5,8-9,16-18H2,1H3,(H,26,28)(H,29,30)