1-[2-(methylideneamino)oxyethyl]piperidine-3-carboxylic acid; 3-methyl-2-(2-methylphenyl)thiophene

Systemtic Name: 1-[2-(methylideneamino)oxyethyl]piperidine-3-carboxylic acid; 3-methyl-2-(2-methylphenyl)thiophene Openeye Name: 1-[2-(methyleneamino)oxyethyl]piperidine-3-carboxylic acid; 3-methyl-2-(o-tolyl)thiophene CAS Name: 1-[2-(methyleneamino)oxyethyl]-3-piperidinecarboxylic acid; 3-methyl-2-(2-methylphenyl)thiophene IUPAC Name: 1-[2-(methylideneamino)oxyethyl]piperidine-3-carboxylic acid; 3-methyl-2-(2-methylphenyl)thiophene Traditional Name: 1-[2-(methyleneamino)oxyethyl]nipecotic acid; 3-methyl-2-(o-tolyl)thiophene Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=CC=CC=C2C.C=NOCCN1CCCC(C1)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C2=CC=CC=C2C.C=NOCCN1CCCC(C1)C(=O)O

InChI

InChI=1S/C12H12S.C9H16N2O3/c1-9-5-3-4-6-11(9)12-10(2)7-8-13-12;1-10-14-6-5-11-4-2-3-8(7-11)9(12)13/h3-8H,1-2H3;8H,1-7H2,(H,12,13)