methyl 6-chloranyl-4-[[1-(naphthalen-2-ylmethyl)piperidin-4-yl]amino]-2-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: methyl 6-chloranyl-4-[[1-(naphthalen-2-ylmethyl)piperidin-4-yl]amino]-2-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: methyl 6-chloro-4-[[1-(2-naphthylmethyl)-4-piperidyl]amino]-2-oxo-1H-quinoline-3-carboxylate CAS Name: 6-chloro-4-[[1-(2-naphthalenylmethyl)-4-piperidinyl]amino]-2-oxo-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 6-chloro-4-[[1-(naphthalen-2-ylmethyl)piperidin-4-yl]amino]-2-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-chloro-2-keto-4-[[1-(2-naphthylmethyl)-4-piperidyl]amino]-1H-quinoline-3-carboxylic acid methyl ester Formula: C27H26ClN3O3 MolecularWeight: 475.96664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CC(=C2)Cl)NC1=O)NC3CCN(CC3)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CC(=C2)Cl)NC1=O)NC3CCN(CC3)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H26ClN3O3/c1-34-27(33)24-25(22-15-20(28)8-9-23(22)30-26(24)32)29-21-10-12-31(13-11-21)16-17-6-7-18-4-2-3-5-19(18)14-17/h2-9,14-15,21H,10-13,16H2,1H3,(H2,29,30,32)