[(3S)-3-[(3,4-dimethoxyphenyl)amino]piperidin-1-yl]-quinoxalin-6-yl-methanone

Systemtic Name: [(3S)-3-[(3,4-dimethoxyphenyl)amino]piperidin-1-yl]-quinoxalin-6-yl-methanone Openeye Name: [(3S)-3-(3,4-dimethoxyanilino)-1-piperidyl]-quinoxalin-6-yl-methanone CAS Name: [(3S)-3-(3,4-dimethoxyanilino)-1-piperidinyl]-(6-quinoxalinyl)methanone IUPAC Name: [(3S)-3-(3,4-dimethoxyanilino)piperidin-1-yl]-quinoxalin-6-ylmethanone Traditional Name: [(3S)-3-(3,4-dimethoxyanilino)piperidino]-quinoxalin-6-yl-methanone Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)C3=CC4=NC=CN=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N[C@H]2CCCN(C2)C(=O)C3=CC4=NC=CN=C4C=C3)OC

InChI

InChI=1S/C22H24N4O3/c1-28-20-8-6-16(13-21(20)29-2)25-17-4-3-11-26(14-17)22(27)15-5-7-18-19(12-15)24-10-9-23-18/h5-10,12-13,17,25H,3-4,11,14H2,1-2H3/t17-/m0/s1