N-[[3-methoxy-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl]-1-piperidin-4-yl-methanamine

Systemtic Name: N-[[3-methoxy-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl]-1-piperidin-4-yl-methanamine Openeye Name: N-[[3-methoxy-4-(1-phenyltetrazol-5-yl)oxy-phenyl]methyl]-1-(4-piperidyl)methanamine CAS Name: N-[[3-methoxy-4-[(1-phenyl-5-tetrazolyl)oxy]phenyl]methyl]-1-(4-piperidinyl)methanamine IUPAC Name: N-[[3-methoxy-4-(1-phenyltetrazol-5-yl)oxyphenyl]methyl]-1-piperidin-4-ylmethanamine Traditional Name: [3-methoxy-4-(1-phenyltetrazol-5-yl)oxy-benzyl]-(4-piperidylmethyl)amine Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC2CCNCC2)OC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC2CCNCC2)OC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H26N6O2/c1-28-20-13-17(15-23-14-16-9-11-22-12-10-16)7-8-19(20)29-21-24-25-26-27(21)18-5-3-2-4-6-18/h2-8,13,16,22-23H,9-12,14-15H2,1H3