1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]hex-5-en-2-ol

Systemtic Name: 1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]hex-5-en-2-ol Openeye Name: 1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]hex-5-en-2-ol CAS Name: 1-[[1-[(4-tert-butylphenyl)methyl]-2-pyrrolyl]methyl-[2-(1-pyrrolidinyl)ethyl]amino]-5-hexen-2-ol IUPAC Name: 1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]hex-5-en-2-ol Traditional Name: 1-[[1-(4-tert-butylbenzyl)pyrrol-2-yl]methyl-(2-pyrrolidinoethyl)amino]hex-5-en-2-ol Formula: C28H43N3O MolecularWeight: 437.66052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=CC=C2CN(CCN3CCCC3)CC(CCC=C)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=CC=C2CN(CCN3CCCC3)CC(CCC=C)O

InChI

InChI=1S/C28H43N3O/c1-5-6-11-27(32)23-30(20-19-29-16-7-8-17-29)22-26-10-9-18-31(26)21-24-12-14-25(15-13-24)28(2,3)4/h5,9-10,12-15,18,27,32H,1,6-8,11,16-17,19-23H2,2-4H3