N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(tetrazol-1-yl)benzamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-(1-tetrazolyl)benzamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-(tetrazol-1-yl)benzamide Traditional Name: N-[2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]-4-(tetrazol-1-yl)benzamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)N3C=NN=N3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)N3C=NN=N3)N4CCCC4

InChI

InChI=1S/C21H24N6O2/c1-29-19-10-6-16(7-11-19)20(26-12-2-3-13-26)14-22-21(28)17-4-8-18(9-5-17)27-15-23-24-25-27/h4-11,15,20H,2-3,12-14H2,1H3,(H,22,28)