4-azanyl-5-cyano-N-[1-[(4-fluorophenyl)methyl]-3-methoxy-piperidin-4-yl]-2-methoxy-benzamide

Systemtic Name: 4-azanyl-5-cyano-N-[1-[(4-fluorophenyl)methyl]-3-methoxy-piperidin-4-yl]-2-methoxy-benzamide Openeye Name: 4-amino-5-cyano-N-[1-[(4-fluorophenyl)methyl]-3-methoxy-4-piperidyl]-2-methoxy-benzamide CAS Name: 4-amino-5-cyano-N-[1-[(4-fluorophenyl)methyl]-3-methoxy-4-piperidinyl]-2-methoxybenzamide IUPAC Name: 4-amino-5-cyano-N-[1-[(4-fluorophenyl)methyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide Traditional Name: 4-amino-5-cyano-N-[1-(4-fluorobenzyl)-3-methoxy-4-piperidyl]-2-methoxy-benzamide Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=C(C=C(C(=C2)C#N)N)OC)CC3=CC=C(C=C3)F

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=C(C=C(C(=C2)C#N)N)OC)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O3/c1-29-20-10-18(25)15(11-24)9-17(20)22(28)26-19-7-8-27(13-21(19)30-2)12-14-3-5-16(23)6-4-14/h3-6,9-10,19,21H,7-8,12-13,25H2,1-2H3,(H,26,28)