2-(1,2-benzoxazol-3-yl)-1-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanone

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-1-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanone Openeye Name: 2-(1,2-benzoxazol-3-yl)-1-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanone CAS Name: 2-(1,2-benzoxazol-3-yl)-1-[(2R)-2-(4-methoxyphenyl)-1-azepanyl]ethanone IUPAC Name: 2-(1,2-benzoxazol-3-yl)-1-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanone Traditional Name: 2-indoxazen-3-yl-1-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanone Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CC3=NOC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)CC3=NOC4=CC=CC=C43

InChI

InChI=1S/C22H24N2O3/c1-26-17-12-10-16(11-13-17)20-8-3-2-6-14-24(20)22(25)15-19-18-7-4-5-9-21(18)27-23-19/h4-5,7,9-13,20H,2-3,6,8,14-15H2,1H3/t20-/m1/s1