4-[2-(hydroxymethyl)piperidin-1-yl]-9H-pyrimido[4,5-b]indole-6-carboxamide

Systemtic Name: 4-[2-(hydroxymethyl)piperidin-1-yl]-9H-pyrimido[4,5-b]indole-6-carboxamide Openeye Name: 4-[2-(hydroxymethyl)-1-piperidyl]-9H-pyrimido[4,5-b]indole-6-carboxamide CAS Name: 4-[2-(hydroxymethyl)-1-piperidinyl]-9H-pyrimido[4,5-b]indole-6-carboxamide IUPAC Name: 4-[2-(hydroxymethyl)piperidin-1-yl]-9H-pyrimido[4,5-b]indole-6-carboxamide Traditional Name: 4-(2-methylolpiperidino)-9H-pyrimid[4,5-b]indole-6-carboxamide Formula: C17H19N5O2 MolecularWeight: 325.36506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)C2=NC=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N

Isomeric SMILES

C1CCN(C(C1)CO)C2=NC=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N

InChI

InChI=1S/C17H19N5O2/c18-15(24)10-4-5-13-12(7-10)14-16(21-13)19-9-20-17(14)22-6-2-1-3-11(22)8-23/h4-5,7,9,11,23H,1-3,6,8H2,(H2,18,24)(H,19,20,21)