2-(2,4-dipyrrolidin-1-ylpyrimido[4,5-b]indol-9-yl)ethanoic acid hydrochloride

Systemtic Name: 2-(2,4-dipyrrolidin-1-ylpyrimido[4,5-b]indol-9-yl)ethanoic acid hydrochloride Openeye Name: 2-(2,4-dipyrrolidin-1-ylpyrimido[4,5-b]indol-9-yl)acetic acid hydrochloride CAS Name: 2-[2,4-bis(1-pyrrolidinyl)-9-pyrimido[4,5-b]indolyl]acetic acid hydrochloride IUPAC Name: 2-(2,4-dipyrrolidin-1-ylpyrimido[4,5-b]indol-9-yl)acetic acid hydrochloride Traditional Name: 2-(2,4-dipyrrolidinopyrimid[4,5-b]indol-9-yl)acetic acid hydrochloride Formula: C20H24ClN5O2 MolecularWeight: 401.88986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2C4=CC=CC=C4N3CC(=O)O)N5CCCC5.Cl

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2C4=CC=CC=C4N3CC(=O)O)N5CCCC5.Cl

InChI

InChI=1S/C20H23N5O2.ClH/c26-16(27)13-25-15-8-2-1-7-14(15)17-18(23-9-3-4-10-23)21-20(22-19(17)25)24-11-5-6-12-24;/h1-2,7-8H,3-6,9-13H2,(H,26,27);1H