2-[[bis(2-pyrrolidin-1-ylethyl)amino]methyl]-4-methyl-6-[(pyridin-2-ylmethylamino)methyl]phenol

Systemtic Name: 2-[[bis(2-pyrrolidin-1-ylethyl)amino]methyl]-4-methyl-6-[(pyridin-2-ylmethylamino)methyl]phenol Openeye Name: 2-[[bis(2-pyrrolidin-1-ylethyl)amino]methyl]-4-methyl-6-[(2-pyridylmethylamino)methyl]phenol CAS Name: 2-[[bis[2-(1-pyrrolidinyl)ethyl]amino]methyl]-4-methyl-6-[(2-pyridinylmethylamino)methyl]phenol IUPAC Name: 2-[[bis(2-pyrrolidin-1-ylethyl)amino]methyl]-4-methyl-6-[(pyridin-2-ylmethylamino)methyl]phenol Traditional Name: 2-[[bis(2-pyrrolidinoethyl)amino]methyl]-4-methyl-6-[(2-pyridylmethylamino)methyl]phenol Formula: C27H41N5O MolecularWeight: 451.64734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CN(CCN2CCCC2)CCN3CCCC3)O)CNCC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(C(=C1)CN(CCN2CCCC2)CCN3CCCC3)O)CNCC4=CC=CC=N4

InChI

InChI=1S/C27H41N5O/c1-23-18-24(20-28-21-26-8-2-3-9-29-26)27(33)25(19-23)22-32(16-14-30-10-4-5-11-30)17-15-31-12-6-7-13-31/h2-3,8-9,18-19,28,33H,4-7,10-17,20-22H2,1H3