(3S)-N-(6-chloranyl-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[2-oxidanylidene-2-(3-oxidanylpiperidin-1-yl)ethyl]morpholine-3-carboxamide

Systemtic Name: (3S)-N-(6-chloranyl-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[2-oxidanylidene-2-(3-oxidanylpiperidin-1-yl)ethyl]morpholine-3-carboxamide Openeye Name: (3S)-N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-4-[2-(3-hydroxy-1-piperidyl)-2-oxo-ethyl]-6,6-dimethyl-morpholine-3-carboxamide CAS Name: (3S)-N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-4-[2-(3-hydroxy-1-piperidinyl)-2-oxoethyl]-6,6-dimethyl-3-morpholinecarboxamide IUPAC Name: (3S)-N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-4-[2-(3-hydroxypiperidin-1-yl)-2-oxoethyl]-6,6-dimethylmorpholine-3-carboxamide Traditional Name: (3S)-N-(6-chloro-9H-$b-carbolin-8-yl)-4-[2-(3-hydroxypiperidino)-2-keto-ethyl]-6,6-dimethyl-morpholine-3-carboxamide Formula: C25H30ClN5O4 MolecularWeight: 499.9898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(CO1)C(=O)NC2=C3C(=CC(=C2)Cl)C4=C(N3)C=NC=C4)CC(=O)N5CCCC(C5)O)C

Isomeric SMILES

CC1(CN([C@@H](CO1)C(=O)NC2=C3C(=CC(=C2)Cl)C4=C(N3)C=NC=C4)CC(=O)N5CCCC(C5)O)C

InChI

InChI=1S/C25H30ClN5O4/c1-25(2)14-31(12-22(33)30-7-3-4-16(32)11-30)21(13-35-25)24(34)29-19-9-15(26)8-18-17-5-6-27-10-20(17)28-23(18)19/h5-6,8-10,16,21,28,32H,3-4,7,11-14H2,1-2H3,(H,29,34)/t16?,21-/m0/s1