[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 6-chloranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 6-chloranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 6-chloro-2-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-3-quinolinecarboxylic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 6-chloro-2-methylquinoline-3-carboxylate Traditional Name: 6-chloro-2-methyl-quinoline-3-carboxylic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OC(C)C(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OC(C)C(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21ClN2O4/c1-13-19(11-16-10-17(23)6-9-20(16)25-13)22(27)29-14(2)21(26)24-12-15-4-7-18(28-3)8-5-15/h4-11,14H,12H2,1-3H3,(H,24,26)