2-[(R)-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(R)-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(R)-(1-tert-butyltetrazol-5-yl)-phenyl-methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(R)-(1-tert-butyl-5-tetrazolyl)-phenylmethyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(R)-(1-tert-butyltetrazol-5-yl)-phenylmethyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[(R)-(1-tert-butyltetrazol-5-yl)-phenyl-methyl]-3,4-dihydro-1H-isoquinoline Formula: C21H25N5 MolecularWeight: 347.4567

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)[C@@H](C2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H25N5/c1-21(2,3)26-20(22-23-24-26)19(17-10-5-4-6-11-17)25-14-13-16-9-7-8-12-18(16)15-25/h4-12,19H,13-15H2,1-3H3/t19-/m1/s1