11-pyrrolidin-1-yl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid

Systemtic Name: 11-pyrrolidin-1-yl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid Openeye Name: 11-pyrrolidin-1-yl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid CAS Name: 11-(1-pyrrolidinyl)-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid IUPAC Name: 11-pyrrolidin-1-yl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid Traditional Name: 11-pyrrolidino-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)N2C3=CC=CC=C3CC4=C2NC(CCC4)C(=O)O

Isomeric SMILES

C1CCN(C1)N2C3=CC=CC=C3CC4=C2NC(CCC4)C(=O)O

InChI

InChI=1S/C18H23N3O2/c22-18(23)15-8-5-7-14-12-13-6-1-2-9-16(13)21(17(14)19-15)20-10-3-4-11-20/h1-2,6,9,15,19H,3-5,7-8,10-12H2,(H,22,23)