azepan-1-yl-[1-[[(3R)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[[(3R)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[(3R)-6-chlorochromane-3-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[(3R)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[(3R)-6-chloro-3,4-dihydro-2H-chromene-3-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[(3R)-6-chlorochroman-3-carbonyl]-4-piperidyl]methanone Formula: C22H29ClN2O3 MolecularWeight: 404.93026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)[C@@H]3CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C22H29ClN2O3/c23-19-5-6-20-17(14-19)13-18(15-28-20)22(27)25-11-7-16(8-12-25)21(26)24-9-3-1-2-4-10-24/h5-6,14,16,18H,1-4,7-13,15H2/t18-/m1/s1