1-[2-[(E)-(1-phenylpyrrol-2-yl)methylideneamino]oxyethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[(E)-(1-phenylpyrrol-2-yl)methylideneamino]oxyethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[(E)-(1-phenylpyrrol-2-yl)methyleneamino]oxyethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[(E)-(1-phenyl-2-pyrrolyl)methylideneamino]oxyethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[(E)-(1-phenylpyrrol-2-yl)methylideneamino]oxyethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[(E)-(1-phenylpyrrol-2-yl)methyleneamino]oxyethyl]nipecotic acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCON=CC2=CC=CN2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCO/N=C/C2=CC=CN2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H23N3O3/c23-19(24)16-6-4-10-21(15-16)12-13-25-20-14-18-9-5-11-22(18)17-7-2-1-3-8-17/h1-3,5,7-9,11,14,16H,4,6,10,12-13,15H2,(H,23,24)/b20-14+