(phenylmethyl) 4-[(quinolin-4-ylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(quinolin-4-ylamino)methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[(4-quinolylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[(4-quinolinylamino)methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(quinolin-4-ylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(4-quinolylamino)methyl]piperidine-1-carboxylic acid benzyl ester Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=CC=NC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CNC2=CC=NC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2/c27-23(28-17-19-6-2-1-3-7-19)26-14-11-18(12-15-26)16-25-22-10-13-24-21-9-5-4-8-20(21)22/h1-10,13,18H,11-12,14-17H2,(H,24,25)