azepan-1-yl-[1-[(2-phenyl-1,2,3-triazol-4-yl)carbonyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[(2-phenyl-1,2,3-triazol-4-yl)carbonyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(2-phenyltriazole-4-carbonyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[oxo-(2-phenyl-4-triazolyl)methyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(2-phenyltriazole-4-carbonyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(2-phenyltriazole-4-carbonyl)-4-piperidyl]methanone Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2/c27-20(24-12-6-1-2-7-13-24)17-10-14-25(15-11-17)21(28)19-16-22-26(23-19)18-8-4-3-5-9-18/h3-5,8-9,16-17H,1-2,6-7,10-15H2