5-piperidin-4-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine-4-carboxylic acid

Systemtic Name: 5-piperidin-4-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine-4-carboxylic acid Openeye Name: 5-(4-piperidyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine-4-carboxylic acid CAS Name: 5-(4-piperidinyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine-4-carboxylic acid IUPAC Name: 5-piperidin-4-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine-4-carboxylic acid Traditional Name: 5-(4-piperidyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine-4-carboxylic acid Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2CC3=CC=CC=C3N4C=CC=C4C2C(=O)O

Isomeric SMILES

C1CNCCC1N2CC3=CC=CC=C3N4C=CC=C4C2C(=O)O

InChI

InChI=1S/C18H21N3O2/c22-18(23)17-16-6-3-11-20(16)15-5-2-1-4-13(15)12-21(17)14-7-9-19-10-8-14/h1-6,11,14,17,19H,7-10,12H2,(H,22,23)