(3S,4aR,6S,8aR)-6-[1-(2H-1,2,3,4-tetrazol-5-yl)propan-2-yl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid

Systemtic Name: (3S,4aR,6S,8aR)-6-[1-(2H-1,2,3,4-tetrazol-5-yl)propan-2-yl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid Openeye Name: (3S,4aR,6S,8aR)-6-[1-methyl-2-(2H-tetrazol-5-yl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid CAS Name: (3S,4aR,6S,8aR)-6-[1-(2H-tetrazol-5-yl)propan-2-yl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid IUPAC Name: (3S,4aR,6S,8aR)-6-[1-(2H-tetrazol-5-yl)propan-2-yl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid Traditional Name: (3S,4aR,6S,8aR)-6-[1-methyl-2-(2H-tetrazol-5-yl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid Formula: C14H23N5O2 MolecularWeight: 293.36472

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NNN=N1)C2CCC3CNC(CC3C2)C(=O)O

Isomeric SMILES

CC(CC1=NNN=N1)[C@H]2CC[C@H]3CN[C@@H](C[C@H]3C2)C(=O)O

InChI

InChI=1S/C14H23N5O2/c1-8(4-13-16-18-19-17-13)9-2-3-10-7-15-12(14(20)21)6-11(10)5-9/h8-12,15H,2-7H2,1H3,(H,20,21)(H,16,17,18,19)/t8?,9-,10-,11+,12-/m0/s1