1-ethanoyl-6-[3-[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]propoxy]quinolin-2-one

Systemtic Name: 1-ethanoyl-6-[3-[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]propoxy]quinolin-2-one Openeye Name: 1-acetyl-6-[3-(1-benzyltetrazol-5-yl)propoxy]quinolin-2-one CAS Name: 1-acetyl-6-[3-[1-(phenylmethyl)-5-tetrazolyl]propoxy]-2-quinolinone IUPAC Name: 1-acetyl-6-[3-(1-benzyltetrazol-5-yl)propoxy]quinolin-2-one Traditional Name: 1-acetyl-6-[3-(1-benzyltetrazol-5-yl)propoxy]carbostyril Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C=CC1=O)C=C(C=C2)OCCCC3=NN=NN3CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C2=C(C=CC1=O)C=C(C=C2)OCCCC3=NN=NN3CC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-16(28)27-20-11-10-19(14-18(20)9-12-22(27)29)30-13-5-8-21-23-24-25-26(21)15-17-6-3-2-4-7-17/h2-4,6-7,9-12,14H,5,8,13,15H2,1H3