3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(phenylmethyl)amino]methyl]-7-methoxy-1H-quinolin-2-one

Systemtic Name: 3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(phenylmethyl)amino]methyl]-7-methoxy-1H-quinolin-2-one Openeye Name: 3-[[benzyl-[(1-cyclohexyltetrazol-5-yl)methyl]amino]methyl]-7-methoxy-1H-quinolin-2-one CAS Name: 3-[[(1-cyclohexyl-5-tetrazolyl)methyl-(phenylmethyl)amino]methyl]-7-methoxy-1H-quinolin-2-one IUPAC Name: 3-[[benzyl-[(1-cyclohexyltetrazol-5-yl)methyl]amino]methyl]-7-methoxy-1H-quinolin-2-one Traditional Name: 3-[[benzyl-[(1-cyclohexyltetrazol-5-yl)methyl]amino]methyl]-7-methoxy-carbostyril Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)CC4=NN=NN4C5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)CC4=NN=NN4C5CCCCC5

InChI

InChI=1S/C26H30N6O2/c1-34-23-13-12-20-14-21(26(33)27-24(20)15-23)17-31(16-19-8-4-2-5-9-19)18-25-28-29-30-32(25)22-10-6-3-7-11-22/h2,4-5,8-9,12-15,22H,3,6-7,10-11,16-18H2,1H3,(H,27,33)