(3R,6R)-6-[[bis(2-methylphenyl)methylideneamino]oxymethyl]piperidine-3-carboxylic acid

Systemtic Name: (3R,6R)-6-[[bis(2-methylphenyl)methylideneamino]oxymethyl]piperidine-3-carboxylic acid Openeye Name: (3R,6R)-6-[(bis-o-tolylmethyleneamino)oxymethyl]piperidine-3-carboxylic acid CAS Name: (3R,6R)-6-[[bis(2-methylphenyl)methylideneamino]oxymethyl]-3-piperidinecarboxylic acid IUPAC Name: (3R,6R)-6-[[bis(2-methylphenyl)methylideneamino]oxymethyl]piperidine-3-carboxylic acid Traditional Name: (3R,6R)-6-[(bis-o-tolylmethyleneamino)oxymethyl]nipecotic acid Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=NOCC2CCC(CN2)C(=O)O)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC=C1C(=NOC[C@H]2CC[C@H](CN2)C(=O)O)C3=CC=CC=C3C

InChI

InChI=1S/C22H26N2O3/c1-15-7-3-5-9-19(15)21(20-10-6-4-8-16(20)2)24-27-14-18-12-11-17(13-23-18)22(25)26/h3-10,17-18,23H,11-14H2,1-2H3,(H,25,26)/t17-,18-/m1/s1