2-phosphonato-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrrolidine-3-carbaldehyde hydrochloride

Systemtic Name: 2-phosphonato-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrrolidine-3-carbaldehyde hydrochloride Openeye Name: 2-phosphonato-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrrolidine-3-carbaldehyde hydrochloride CAS Name: 2-phosphonato-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-3-pyrrolidinecarboxaldehyde hydrochloride IUPAC Name: 2-phosphonato-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrrolidine-3-carbaldehyde hydrochloride Traditional Name: 2-phosphonato-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrrolidine-3-carbaldehyde hydrochloride Formula: C14H18ClN2O4P-2 MolecularWeight: 344.730481

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1C=O)P(=O)([O-])[O-])C2C3=CC=CC=C3CCN2.Cl

Isomeric SMILES

C1CN(C(C1C=O)P(=O)([O-])[O-])C2C3=CC=CC=C3CCN2.Cl

InChI

InChI=1S/C14H19N2O4P.ClH/c17-9-11-6-8-16(14(11)21(18,19)20)13-12-4-2-1-3-10(12)5-7-15-13;/h1-4,9,11,13-15H,5-8H2,(H2,18,19,20);1H/p-2