4-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxy-phenol

Systemtic Name: 4-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxy-phenol Openeye Name: 4-[(1-tert-butyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxy-phenol CAS Name: 4-[(1-tert-butyl-5-tetrazolyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxyphenol IUPAC Name: 4-[(1-tert-butyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxyphenol Traditional Name: 4-[(1-tert-butyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxy-phenol Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)C(C2=CC(=C(C=C2)O)OC)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)C(C2=CC(=C(C=C2)O)OC)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N5O2/c1-22(2,3)27-21(23-24-25-27)20(16-9-10-18(28)19(13-16)29-4)26-12-11-15-7-5-6-8-17(15)14-26/h5-10,13,20,28H,11-12,14H2,1-4H3