methyl 2-[5-[(2-azanylethylamino)-phenyl-methyl]-1,2,3,4-tetrazol-1-yl]ethanoate

Systemtic Name: methyl 2-[5-[(2-azanylethylamino)-phenyl-methyl]-1,2,3,4-tetrazol-1-yl]ethanoate Openeye Name: methyl 2-[5-[(2-aminoethylamino)-phenyl-methyl]tetrazol-1-yl]acetate CAS Name: 2-[5-[(2-aminoethylamino)-phenylmethyl]-1-tetrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[(2-aminoethylamino)-phenylmethyl]tetrazol-1-yl]acetate Traditional Name: 2-[5-[(2-aminoethylamino)-phenyl-methyl]tetrazol-1-yl]acetic acid methyl ester Formula: C13H18N6O2 MolecularWeight: 290.32102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=NN=N1)C(C2=CC=CC=C2)NCCN

Isomeric SMILES

COC(=O)CN1C(=NN=N1)C(C2=CC=CC=C2)NCCN

InChI

InChI=1S/C13H18N6O2/c1-21-11(20)9-19-13(16-17-18-19)12(15-8-7-14)10-5-3-2-4-6-10/h2-6,12,15H,7-9,14H2,1H3