3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-(3-oxidanylpropyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one

Systemtic Name: 3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-(3-oxidanylpropyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one Openeye Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(3-hydroxypropyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one CAS Name: 3-[[(1-tert-butyl-5-tetrazolyl)methyl-(3-hydroxypropyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one IUPAC Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(3-hydroxypropyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one Traditional Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(3-hydroxypropyl)amino]methyl]-6-ethoxy-carbostyril Formula: C21H30N6O3 MolecularWeight: 414.5013

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)CC3=NN=NN3C(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)CC3=NN=NN3C(C)(C)C

InChI

InChI=1S/C21H30N6O3/c1-5-30-17-7-8-18-15(12-17)11-16(20(29)22-18)13-26(9-6-10-28)14-19-23-24-25-27(19)21(2,3)4/h7-8,11-12,28H,5-6,9-10,13-14H2,1-4H3,(H,22,29)