ethyl 4-[6-methyl-3-[(1-oxidanylpropan-2-ylamino)methyl]quinolin-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-3-[(1-oxidanylpropan-2-ylamino)methyl]quinolin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[[(2-hydroxy-1-methyl-ethyl)amino]methyl]-6-methyl-2-quinolyl]piperazine-1-carboxylate CAS Name: 4-[3-[(1-hydroxypropan-2-ylamino)methyl]-6-methyl-2-quinolinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(1-hydroxypropan-2-ylamino)methyl]-6-methylquinolin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[[(2-hydroxy-1-methyl-ethyl)amino]methyl]-6-methyl-2-quinolyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)CNC(C)CO

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)CNC(C)CO

InChI

InChI=1S/C21H30N4O3/c1-4-28-21(27)25-9-7-24(8-10-25)20-18(13-22-16(3)14-26)12-17-11-15(2)5-6-19(17)23-20/h5-6,11-12,16,22,26H,4,7-10,13-14H2,1-3H3