azepan-1-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone Openeye Name: azepan-1-yl-[1-(3-phenylpropylsulfonyl)-3-piperidyl]methanone CAS Name: 1-azepanyl-[1-(3-phenylpropylsulfonyl)-3-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone Traditional Name: azepan-1-yl-[1-(3-phenylpropylsulfonyl)-3-piperidyl]methanone Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H32N2O3S/c24-21(22-14-6-1-2-7-15-22)20-13-8-16-23(18-20)27(25,26)17-9-12-19-10-4-3-5-11-19/h3-5,10-11,20H,1-2,6-9,12-18H2