3-[[(4-tert-butylphenyl)methyl-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]amino]methyl]phenol

Systemtic Name: 3-[[(4-tert-butylphenyl)methyl-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]amino]methyl]phenol Openeye Name: 3-[[(4-tert-butylphenyl)methyl-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]amino]methyl]phenol CAS Name: 3-[[(4-tert-butylphenyl)methyl-[2-[(2S)-1-methyl-2-pyrrolidinyl]ethyl]amino]methyl]phenol IUPAC Name: 3-[[(4-tert-butylphenyl)methyl-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]amino]methyl]phenol Traditional Name: 3-[[(4-tert-butylbenzyl)-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]amino]methyl]phenol Formula: C25H36N2O MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CCC2CCCN2C)CC3=CC(=CC=C3)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC[C@@H]2CCCN2C)CC3=CC(=CC=C3)O

InChI

InChI=1S/C25H36N2O/c1-25(2,3)22-12-10-20(11-13-22)18-27(16-14-23-8-6-15-26(23)4)19-21-7-5-9-24(28)17-21/h5,7,9-13,17,23,28H,6,8,14-16,18-19H2,1-4H3/t23-/m0/s1