3-[azepan-1-yl-[1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-8-methyl-1H-quinolin-2-one

Systemtic Name: 3-[azepan-1-yl-[1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-8-methyl-1H-quinolin-2-one Openeye Name: 3-[azepan-1-yl-[1-(tetrahydrofuran-2-ylmethyl)tetrazol-5-yl]methyl]-8-methyl-1H-quinolin-2-one CAS Name: 3-[1-azepanyl-[1-(2-oxolanylmethyl)-5-tetrazolyl]methyl]-8-methyl-1H-quinolin-2-one IUPAC Name: 3-[azepan-1-yl-[1-(oxolan-2-ylmethyl)tetrazol-5-yl]methyl]-8-methyl-1H-quinolin-2-one Traditional Name: 3-[azepan-1-yl-[1-(tetrahydrofurfuryl)tetrazol-5-yl]methyl]-8-methyl-carbostyril Formula: C23H30N6O2 MolecularWeight: 422.5233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3CC4CCCO4)N5CCCCCC5

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3CC4CCCO4)N5CCCCCC5

InChI

InChI=1S/C23H30N6O2/c1-16-8-6-9-17-14-19(23(30)24-20(16)17)21(28-11-4-2-3-5-12-28)22-25-26-27-29(22)15-18-10-7-13-31-18/h6,8-9,14,18,21H,2-5,7,10-13,15H2,1H3,(H,24,30)