4-[1-[4-[1-(phenethylamino)cyclopropyl]phenyl]ethyl]benzoic acid

Systemtic Name: 4-[1-[4-[1-(phenethylamino)cyclopropyl]phenyl]ethyl]benzoic acid Openeye Name: 4-[1-[4-[1-(phenethylamino)cyclopropyl]phenyl]ethyl]benzoic acid CAS Name: 4-[1-[4-[1-(phenethylamino)cyclopropyl]phenyl]ethyl]benzoic acid IUPAC Name: 4-[1-[4-[1-(phenethylamino)cyclopropyl]phenyl]ethyl]benzoic acid Traditional Name: 4-[1-[4-[1-(phenethylamino)cyclopropyl]phenyl]ethyl]benzoic acid Formula: C26H27NO2 MolecularWeight: 385.49808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)O)C2=CC=C(C=C2)C3(CC3)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)O)C2=CC=C(C=C2)C3(CC3)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H27NO2/c1-19(21-7-9-23(10-8-21)25(28)29)22-11-13-24(14-12-22)26(16-17-26)27-18-15-20-5-3-2-4-6-20/h2-14,19,27H,15-18H2,1H3,(H,28,29)