1-(3-butoxy-4-methoxy-phenyl)-1-[(4-tert-butylphenyl)methyl]-2-morpholin-4-yl-guanidine hydrochloride

Systemtic Name: 1-(3-butoxy-4-methoxy-phenyl)-1-[(4-tert-butylphenyl)methyl]-2-morpholin-4-yl-guanidine hydrochloride Openeye Name: 1-(3-butoxy-4-methoxy-phenyl)-1-[(4-tert-butylphenyl)methyl]-2-morpholino-guanidine hydrochloride CAS Name: 1-(3-butoxy-4-methoxyphenyl)-1-[(4-tert-butylphenyl)methyl]-2-(4-morpholinyl)guanidine hydrochloride IUPAC Name: 1-(3-butoxy-4-methoxyphenyl)-1-[(4-tert-butylphenyl)methyl]-2-morpholin-4-ylguanidine hydrochloride Traditional Name: 1-(3-butoxy-4-methoxy-phenyl)-1-(4-tert-butylbenzyl)-2-morpholino-guanidine hydrochloride Formula: C27H41ClN4O3 MolecularWeight: 505.09244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)N(CC2=CC=C(C=C2)C(C)(C)C)C(=NN3CCOCC3)N)OC.Cl

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)N(CC2=CC=C(C=C2)C(C)(C)C)/C(=N\N3CCOCC3)/N)OC.Cl

InChI

InChI=1S/C27H40N4O3.ClH/c1-6-7-16-34-25-19-23(12-13-24(25)32-5)31(26(28)29-30-14-17-33-18-15-30)20-21-8-10-22(11-9-21)27(2,3)4;/h8-13,19H,6-7,14-18,20H2,1-5H3,(H2,28,29);1H