ethyl 1-(8-chloranyl-5H-pyrimido[5,4-b]indol-4-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(8-chloranyl-5H-pyrimido[5,4-b]indol-4-yl)piperidine-4-carboxylate Openeye Name: ethyl 1-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)piperidine-4-carboxylate CAS Name: 1-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)piperidine-4-carboxylate Traditional Name: 1-(8-chloro-5H-pyrimid[5,4-b]indol-4-yl)isonipecotic acid ethyl ester Formula: C18H19ClN4O2 MolecularWeight: 358.82206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC=NC3=C2NC4=C3C=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC=NC3=C2NC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C18H19ClN4O2/c1-2-25-18(24)11-5-7-23(8-6-11)17-16-15(20-10-21-17)13-9-12(19)3-4-14(13)22-16/h3-4,9-11,22H,2,5-8H2,1H3