2-(2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-phenyl-ethanamine hydrate

Systemtic Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-phenyl-ethanamine hydrate Openeye Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-phenyl-ethanamine hydrate CAS Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-phenylethanamine hydrate IUPAC Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-phenylethanamine hydrate Traditional Name: [2-(2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-phenyl-ethyl]amine hydrate Formula: C19H21N3O MolecularWeight: 307.38954

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=NC3=CC=CC=C3C(=C21)C(CN)C4=CC=CC=C4.O

Isomeric SMILES

C1CNC2=NC3=CC=CC=C3C(=C21)C(CN)C4=CC=CC=C4.O

InChI

InChI=1S/C19H19N3.H2O/c20-12-16(13-6-2-1-3-7-13)18-14-8-4-5-9-17(14)22-19-15(18)10-11-21-19;/h1-9,16H,10-12,20H2,(H,21,22);1H2